Navigation

name Structure Reference Source Properties Activities Metabolism

Metoprolol

AlkaPlorer ID: AK320512

Synonym: None

IUPAC Name: 1-[4-(2-methoxyethyl)phenoxy]-3-(propan-2-ylamino)propan-2-ol

Structure

SMILES: COCCC1=CC=C(OCC(O)CNC(C)C)C=C1

copy

InChI: InChI=1S/C15H25NO3/c1-12(2)16-10-14(17)11-19-15-6-4-13(5-7-15)8-9-18-3/h4-7,12,14,16-17H,8-11H2,1-3H3

copy

InChIKey: IUBSYMUCCVWXPE-UHFFFAOYSA-N

copy

Reference

PubChem CID: 4171

CAS: 13484-40-7

NPASS: NPC320242

COCONUT: CNP0337246.2

Properties Information

Molecule Weight: 267.369

TPSA？: 50.72

MolLogP？: 1.6132

Number of H-Donors: 2

Number of H-Acceptors: 4

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
Bos mutus Dipeptidyl peptidase 3 IC50 315000.0 nM 10.1007/s00044-010-9454-7
Bos mutus Dipeptidyl peptidase 3 Inhibition 70.0 % 10.1007/s00044-010-9454-7
Bos mutus Dipeptidyl peptidase 3 Inhibition nan % 10.1007/s00044-010-9454-7
Bos mutus Dipeptidyl peptidase 3 Ki 230000.0 nM 10.1007/s00044-010-9454-7
Bos taurus Progesterone receptor IC50 nan None None
Bos taurus Progesterone receptor Ki nan None None
Canis lupus familiaris Beta-2 adrenergic receptor ED50 2.0 mg.kg-1 10.1021/jm00365a005
Canis lupus familiaris Beta-2 adrenergic receptor ED50 2.0 mg.kg-1 10.1021/jm00370a012
Canis lupus familiaris MDCK logPapp -4.7 None 10.1021/jm901846t
Canis lupus familiaris MDCK Papp 15.6 10'6cm/s 10.1016/j.bmcl.2011.05.058
Canis lupus familiaris MDCK Papp 18.54 10'-6 cm/s 10.1016/j.ejmech.2015.10.040
Canis lupus familiaris MDCK Papp 24.3 10'-6 cm/s 10.1016/j.ejmech.2015.10.040
Canis lupus familiaris MDCK Ratio 0.76 None 10.1016/j.ejmech.2015.10.040
Cavia porcellus Beta-1 adrenergic receptor IC50 190.0 nM 10.1016/S0960-894X(97)00207-2
Cavia porcellus Beta-1 adrenergic receptor IC50 320.0 nM 10.1016/S0960-894X(97)00207-2
Cavia porcellus Beta-1 adrenergic receptor Kd 14.79 nM 10.1021/jm00156a028
Cavia porcellus Beta-1 adrenergic receptor Kd 14.79 nM 10.1021/jm00350a009
Cavia porcellus Beta-1 adrenergic receptor Kd 14.79 nM 10.1021/jm00361a004
Cavia porcellus Beta-1 adrenergic receptor Kd 724.44 nM 10.1021/jm00389a008
Cavia porcellus Beta-2 adrenergic receptor Kd 162.18 nM 10.1021/jm00156a028
Cavia porcellus Beta-2 adrenergic receptor Kd 162.18 nM 10.1021/jm00350a009
Cavia porcellus Beta-2 adrenergic receptor Kd 162.18 nM 10.1021/jm00361a004
Cavia porcellus Cavia porcellus Log B/F 1.619 None 10.1021/jm00179a017
Cavia porcellus Leukotriene C4 synthase IC50 nan None None
Cavia porcellus Leukotriene C4 synthase Ki nan None None
Cavia porcellus Serotonin 4 (5-HT4) receptor IC50 nan None None
Cavia porcellus Serotonin 4 (5-HT4) receptor Ki nan None None
Danio rerio Danio rerio Activity 17.0 % 10.1021/acs.jnatprod.9b00857
Danio rerio Danio rerio Activity 29.0 % 10.1021/acs.jnatprod.9b00857
Danio rerio Danio rerio Activity 34.0 % 10.1021/acs.jnatprod.9b00857
Danio rerio Danio rerio Activity 35.0 % 10.1021/acs.jnatprod.9b00857
Homo sapiens A-375 IC50 100000.0 nM 10.1016/j.bmc.2020.115404
Homo sapiens A-375 Inhibition 26.3 % 10.1016/j.bmc.2020.115404
Homo sapiens Acetylcholinesterase IC50 nan None None
Homo sapiens Acetylcholinesterase Ki nan None None
Homo sapiens Adenosine A1 receptor AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Adenosine A1 receptor IC50 nan None None
Homo sapiens Adenosine A1 receptor Ki nan None None
Homo sapiens Adenosine A2a receptor AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Adenosine A2a receptor IC50 nan None None
Homo sapiens Adenosine A2a receptor Ki nan None None
Homo sapiens Adenosine A3 receptor AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Adenosine A3 receptor IC50 nan None None
Homo sapiens Adenosine A3 receptor Ki nan None None
Homo sapiens Adrenergic receptor beta Activity 5.63 None 10.1016/S0960-894X(97)00046-2
Homo sapiens Adrenergic receptor beta ISA nan None 10.1021/jm00119a004
Homo sapiens Adrenergic receptor beta; ADRB1 & ADRB2 Ratio 11.0 None 10.1021/jm00156a028
Homo sapiens Adrenergic receptor beta; ADRB1 & ADRB2 Ratio 11.0 None 10.1021/jm00361a004
Homo sapiens Alpha-1a adrenergic receptor AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Alpha-1a adrenergic receptor AC50 14617.1 nM 10.1038/s41467-023-40064-9
Homo sapiens Alpha-1a adrenergic receptor AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Alpha-1d adrenergic receptor IC50 nan None None
Homo sapiens Alpha-1d adrenergic receptor Ki nan None None
Homo sapiens Alpha-2a adrenergic receptor AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Alpha-2a adrenergic receptor IC50 nan None None
Homo sapiens Alpha-2a adrenergic receptor Ki nan None None
Homo sapiens Alpha-2b adrenergic receptor AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Alpha-2b adrenergic receptor IC50 nan None None
Homo sapiens Alpha-2b adrenergic receptor Ki nan None None
Homo sapiens Alpha-2c adrenergic receptor AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Alpha-2c adrenergic receptor IC50 nan None None
Homo sapiens Alpha-2c adrenergic receptor Ki nan None None
Homo sapiens Angiotensin II type 2 (AT-2) receptor IC50 nan None None
Homo sapiens Angiotensin II type 2 (AT-2) receptor Ki nan None None
Homo sapiens Beta-1 adrenergic receptor AC50 1532.6 nM 10.1038/s41467-023-40064-9
Homo sapiens Beta-1 adrenergic receptor IC50 176.0 nM None
Homo sapiens Beta-1 adrenergic receptor Kd 15.85 nM 10.1021/acs.jmedchem.5b00201
Homo sapiens Beta-1 adrenergic receptor Ki 55.0 nM 10.1016/j.bmc.2019.05.034
Homo sapiens Beta-1 adrenergic receptor Ki 102.0 nM None
Homo sapiens Beta-1 adrenergic receptor Selectivity nan None 10.1021/jm00119a004
Homo sapiens Beta-2 adrenergic receptor AC50 7249.8 nM 10.1038/s41467-023-40064-9
Homo sapiens Beta-2 adrenergic receptor IC50 2573.0 nM None
Homo sapiens Beta-2 adrenergic receptor Kd 130.0 nM 10.1021/acs.jmedchem.6b00358
Homo sapiens Beta-2 adrenergic receptor Kd 15500.0 nM 10.1021/acs.jmedchem.6b00358
Homo sapiens Beta-2 adrenergic receptor Ki 220.0 nM 10.1016/j.bmc.2019.05.034
Homo sapiens Beta-2 adrenergic receptor Ki 1769.0 nM None
Homo sapiens Beta-2 adrenergic receptor log K 2.1 None 10.1021/acs.jmedchem.6b00358
Homo sapiens Beta-2 adrenergic receptor Selectivity nan None 10.1021/jm00119a004
Homo sapiens Beta-3 adrenergic receptor AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Beta-3 adrenergic receptor IC50 nan None None
Homo sapiens Beta-3 adrenergic receptor Ki nan None None
Homo sapiens Bile salt export pump AC50 300000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Bile salt export pump IC50 133000.0 nM 10.1093/toxsci/kft176
Homo sapiens Bile salt export pump IC50 135000.0 nM 10.1093/toxsci/kfq269
Homo sapiens Bradykinin B1 receptor AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Bradykinin B2 receptor AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Bradykinin B2 receptor IC50 nan None None
Homo sapiens Bradykinin B2 receptor Ki nan None None
Homo sapiens Caco-2 logPapp -4.59 None 10.1016/j.bmc.2009.08.022
Homo sapiens Caco-2 logPapp -4.53 None 10.1016/j.bmc.2011.03.011
Homo sapiens Caco-2 Papp 27.2 ucm/s 10.1016/j.ejmech.2012.01.033
Homo sapiens Caco-2 Papp 29.6 10'6cm/s 10.1016/j.bmcl.2010.12.079
Homo sapiens Caco-2 Papp 29.6 cm/s 10.1016/j.bmcl.2010.08.117
Homo sapiens Caco-2 Papp 29.9 ucm/s 10.1021/np4004905
Homo sapiens Caco-2 permeability 132.0 nm/s 10.1021/jm3016377
Homo sapiens Caco-2 permeability nan None 10.1016/j.bmc.2011.03.011
Homo sapiens Caco-2 Permeability 21.4 *10e6 10.1021/jm990482t
Homo sapiens Caco-2 Permeability 38.2 *10e6 10.1021/jm990482t
Homo sapiens Caco-2 Permeability nan None 10.1021/jm990482t
Homo sapiens Calcitonin receptor IC50 nan None None
Homo sapiens Calcitonin receptor Ki nan None None
Homo sapiens Canalicular multispecific organic anion transporter 1 Activity 72.0 % 10.1021/jm7015683
Homo sapiens Canalicular multispecific organic anion transporter 1 IC50 133000.0 nM 10.1093/toxsci/kft176
Homo sapiens Canalicular multispecific organic anion transporter 2 IC50 133000.0 nM 10.1093/toxsci/kft176
Homo sapiens Cannabinoid CB1 receptor AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Cannabinoid CB1 receptor AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Cannabinoid CB1 receptor IC50 nan None None
Homo sapiens Cannabinoid CB1 receptor Ki nan None None
Homo sapiens Carbonic anhydrase II IC50 nan None None
Homo sapiens Carbonic anhydrase II Ki nan None None
Homo sapiens Caspase-1 IC50 nan None None
Homo sapiens Caspase-1 Ki nan None None
Homo sapiens Cathepsin G IC50 nan None None
Homo sapiens Cathepsin G Ki nan None None
Homo sapiens C-C chemokine receptor type 2 IC50 nan None None
Homo sapiens C-C chemokine receptor type 2 Ki nan None None
Homo sapiens C-C chemokine receptor type 4 IC50 nan None None
Homo sapiens C-C chemokine receptor type 4 Ki nan None None
Homo sapiens C-C chemokine receptor type 5 IC50 nan None None
Homo sapiens C-C chemokine receptor type 5 Ki nan None None
Homo sapiens Cholecystokinin A receptor AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Cholecystokinin A receptor IC50 nan None None
Homo sapiens Cholecystokinin A receptor Ki nan None None
Homo sapiens Cholecystokinin B receptor AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Corticotropin releasing factor receptor 1 AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Corticotropin releasing factor receptor 2 AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Cyclooxygenase-1 IC50 nan None None
Homo sapiens Cyclooxygenase-1 Ki nan None None
Homo sapiens Cyclooxygenase-2 AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Cyclooxygenase-2 IC50 nan None None
Homo sapiens Cyclooxygenase-2 Ki nan None None
Homo sapiens Cysteinyl leukotriene receptor 1 IC50 nan None None
Homo sapiens Cysteinyl leukotriene receptor 1 Ki nan None None
Homo sapiens Cytochrome P450 1A2 IC50 50000.0 nM 10.1124/dmd.112.048264
Homo sapiens Cytochrome P450 1A2 IC50 nan None None
Homo sapiens Cytochrome P450 1A2 Ki nan None None
Homo sapiens Cytochrome P450 2A6 IC50 nan None None
Homo sapiens Cytochrome P450 2A6 Ki nan None None
Homo sapiens Cytochrome P450 2C19 IC50 50000.0 nM 10.1124/dmd.112.048264
Homo sapiens Cytochrome P450 2C19 IC50 nan None None
Homo sapiens Cytochrome P450 2C19 Ki nan None None
Homo sapiens Cytochrome P450 2C9 FC 1.0 None 10.1016/j.bmcl.2016.06.088
Homo sapiens Cytochrome P450 2C9 IC50 50000.0 nM 10.1124/dmd.112.048264
Homo sapiens Cytochrome P450 2C9 IC50 nan None None
Homo sapiens Cytochrome P450 2C9 Ki nan None None
Homo sapiens Cytochrome P450 2D6 FC 1.0 None 10.1016/j.bmcl.2016.06.088
Homo sapiens Cytochrome P450 2D6 IC50 24000.0 nM 10.1016/j.bmcl.2005.06.007
Homo sapiens Cytochrome P450 2D6 IC50 50000.0 nM 10.1124/dmd.112.048264
Homo sapiens Cytochrome P450 2D6 IC50 nan None None
Homo sapiens Cytochrome P450 2D6 Ki nan None None
Homo sapiens Cytochrome P450 2E1 IC50 nan None None
Homo sapiens Cytochrome P450 2E1 Ki nan None None
Homo sapiens Cytochrome P450 2J2 IC50 4870.0 nM 10.1124/dmd.112.048264
Homo sapiens Cytochrome P450 3A4 FC 1.0 None 10.1016/j.bmcl.2016.06.088
Homo sapiens Cytochrome P450 3A4 IC50 50000.0 nM 10.1124/dmd.112.048264
Homo sapiens Cytochrome P450 3A4 IC50 nan None None
Homo sapiens Cytochrome P450 3A4 Ki nan None None
Homo sapiens Delta opioid receptor AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Delta opioid receptor IC50 nan None None
Homo sapiens Delta opioid receptor Ki nan None None
Homo sapiens Dopamine D1 receptor AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Dopamine D1 receptor IC50 nan None None
Homo sapiens Dopamine D1 receptor Ki nan None None
Homo sapiens Dopamine D2 receptor AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Dopamine D2 receptor IC50 nan None None
Homo sapiens Dopamine D2 receptor Ki nan None None
Homo sapiens Dopamine D3 receptor AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Dopamine D3 receptor IC50 nan None None
Homo sapiens Dopamine D3 receptor Ki nan None None
Homo sapiens Dopamine D4 receptor AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Dopamine D4 receptor IC50 nan None None
Homo sapiens Dopamine D4 receptor Ki nan None None
Homo sapiens Dopamine transporter AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Dopamine transporter IC50 nan None None
Homo sapiens Dopamine transporter Ki nan None None
Homo sapiens Endothelin receptor ET-A AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Endothelin receptor ET-A IC50 nan None None
Homo sapiens Endothelin receptor ET-A Ki nan None None
Homo sapiens Endothelin receptor ET-B AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Epidermal growth factor receptor erbB1 IC50 nan None None
Homo sapiens Epidermal growth factor receptor erbB1 Ki nan None None
Homo sapiens Equilibrative nucleoside transporter 1 AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Estrogen receptor alpha AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Estrogen receptor alpha IC50 nan None None
Homo sapiens Estrogen receptor alpha Ki nan None None
Homo sapiens Estrogen receptor beta AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Estrogen receptor beta IC50 nan None None
Homo sapiens Estrogen receptor beta Ki nan None None
Homo sapiens Gastric inhibitory polypeptide receptor AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Ghrelin receptor AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Glucagon receptor AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Glucocorticoid receptor AC50 14709.9 nM 10.1038/s41467-023-40064-9
Homo sapiens Glucocorticoid receptor IC50 nan None None
Homo sapiens Glucocorticoid receptor Ki nan None None
Homo sapiens Hepatocyte CL 12.15 mL.min-1.kg-1 10.1016/j.ejmech.2008.07.027
Homo sapiens Hepatocyte CL 13.0 uL.min-1.(10^6cells)-1 10.1124/dmd.111.042309
Homo sapiens Hepatocyte logCL 1.085 None 10.1016/j.ejmech.2008.07.027
Homo sapiens HERG AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens HERG IC50 nan None None
Homo sapiens HERG Ki nan None None
Homo sapiens Histamine H1 receptor AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Histamine H1 receptor IC50 nan None None
Homo sapiens Histamine H1 receptor Ki nan None None
Homo sapiens Histamine H2 receptor AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Histamine H2 receptor IC50 nan None None
Homo sapiens Histamine H2 receptor Ki nan None None
Homo sapiens Histamine H3 receptor AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Histone deacetylase 6 Inhibition -9.26 % 10.6019/CHEMBL4808148
Homo sapiens Histone deacetylase 6 Inhibition -1.15 % 10.6019/CHEMBL4808148
Homo sapiens HMG-CoA reductase IC50 nan None None
Homo sapiens HMG-CoA reductase Ki nan None None
Homo sapiens Homo sapiens % absorbed 95.0 % 10.1021/jm001020e
Homo sapiens Homo sapiens Absorption 95.0 % 10.1021/jm970530e
Homo sapiens Homo sapiens Absorption 102.0 % 10.1021/jm980527a
Homo sapiens Homo sapiens Activity 0.95 % 10.1016/j.ejmech.2009.11.034
Homo sapiens Homo sapiens CL 12.4 mL.min-1.kg-1 10.1021/jm901371v
Homo sapiens Homo sapiens CL 13.0 mL.min-1.kg-1 10.1021/acs.jmedchem.5b00201
Homo sapiens Homo sapiens CL 13.0 mL.min-1.kg-1 10.1021/jm900403j
Homo sapiens Homo sapiens CL 13.0 mL.min-1.kg-1 10.1021/jm901371v
Homo sapiens Homo sapiens CL 13.3 mL.min-1.kg-1 10.1124/dmd.111.042309
Homo sapiens Homo sapiens CL 33.0 mL.min-1.kg-1 10.1021/acs.jmedchem.5b00201
Homo sapiens Homo sapiens CL_renal 0.65 mL.min-1.kg-1 10.1021/jm900403j
Homo sapiens Homo sapiens CL_renal 0.7 mL.min-1.kg-1 10.1021/jm901371v
Homo sapiens Homo sapiens DILI_Concern nan None 10.1016/j.drudis.2016.02.015
Homo sapiens Homo sapiens DILI_severity_class 5.0 None 10.1016/j.drudis.2016.02.015
Homo sapiens Homo sapiens F 95.0 % 10.1021/jm901846t
Homo sapiens Homo sapiens Fa 0.98 None 10.1021/jm901371v
Homo sapiens Homo sapiens Fa 95.0 % 10.1021/jm991156g
Homo sapiens Homo sapiens FA 100.0 None 10.1021/jm001101a
Homo sapiens Homo sapiens FA 102.0 % 10.1021/jm000942e
Homo sapiens Homo sapiens F_fraction 0.38 None 10.1021/jm901371v
Homo sapiens Homo sapiens Fg 0.84 None 10.1021/jm901371v
Homo sapiens Homo sapiens Fh 0.46 None 10.1021/jm901371v
Homo sapiens Homo sapiens Pc 9.19e-05 cm s-1 10.1021/jm980313t
Homo sapiens Homo sapiens Pc 92000000.0 cm s-1 10.1021/jm001101a
Homo sapiens Homo sapiens Ratio 1.0 None 10.1021/jm001101a
Homo sapiens Homo sapiens T1/2 3.6 hr 10.1021/acs.jmedchem.5b00201
Homo sapiens Homo sapiens Vdss 3.1 L.kg-1 10.1021/acs.jmedchem.5b00201
Homo sapiens Homo sapiens Vdss 3.1 L.kg-1 10.1021/jm901371v
Homo sapiens Homo sapiens Vdss 3.73 L.kg-1 10.1016/j.ejmech.2009.06.004
Homo sapiens Homo sapiens Vdss 4.0 L.kg-1 10.1021/acs.jmedchem.5b00201
Homo sapiens Interleukin-8 receptor A IC50 nan None None
Homo sapiens Interleukin-8 receptor A Ki nan None None
Homo sapiens Interleukin-8 receptor B IC50 nan None None
Homo sapiens Interleukin-8 receptor B Ki nan None None
Homo sapiens Kappa opioid receptor AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Kappa opioid receptor IC50 nan None None
Homo sapiens Kappa opioid receptor Ki nan None None
Homo sapiens Leukocyte common antigen IC50 nan None None
Homo sapiens Leukocyte common antigen Ki nan None None
Homo sapiens Leukocyte elastase IC50 nan None None
Homo sapiens Leukocyte elastase Ki nan None None
Homo sapiens MAP kinase ERK1 IC50 nan None None
Homo sapiens MAP kinase ERK1 Ki nan None None
Homo sapiens MAP kinase ERK2 IC50 nan None None
Homo sapiens MAP kinase ERK2 Ki nan None None
Homo sapiens MAP kinase p38 alpha IC50 nan None None
Homo sapiens MAP kinase p38 alpha Ki nan None None
Homo sapiens Matrix metalloproteinase-1 IC50 nan None None
Homo sapiens Matrix metalloproteinase-1 Ki nan None None
Homo sapiens Matrix metalloproteinase 9 IC50 nan None None
Homo sapiens Matrix metalloproteinase 9 Ki nan None None
Homo sapiens Melanocortin receptor 3 AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Melanocortin receptor 3 IC50 nan None None
Homo sapiens Melanocortin receptor 3 Ki nan None None
Homo sapiens Melanocortin receptor 4 AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Melanocortin receptor 4 IC50 nan None None
Homo sapiens Melanocortin receptor 4 Ki nan None None
Homo sapiens Melanocortin receptor 5 IC50 nan None None
Homo sapiens Melanocortin receptor 5 Ki nan None None
Homo sapiens Monoamine oxidase A AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Monoamine oxidase A IC50 nan None None
Homo sapiens Monoamine oxidase A Ki nan None None
Homo sapiens Motilin receptor AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Multidrug resistance-associated protein 4 IC50 133000.0 nM 10.1093/toxsci/kft176
Homo sapiens Mu opioid receptor AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Mu opioid receptor IC50 nan None None
Homo sapiens Mu opioid receptor Ki nan None None
Homo sapiens Muscarinic acetylcholine receptor M1 AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Muscarinic acetylcholine receptor M1 IC50 nan None None
Homo sapiens Muscarinic acetylcholine receptor M1 Ki nan None None
Homo sapiens Muscarinic acetylcholine receptor M2 AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Muscarinic acetylcholine receptor M2 IC50 nan None None
Homo sapiens Muscarinic acetylcholine receptor M2 Ki nan None None
Homo sapiens Muscarinic acetylcholine receptor M3 AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Muscarinic acetylcholine receptor M3 IC50 nan None None
Homo sapiens Muscarinic acetylcholine receptor M3 Ki nan None None
Homo sapiens Muscarinic acetylcholine receptor M4 IC50 nan None None
Homo sapiens Muscarinic acetylcholine receptor M4 Ki nan None None
Homo sapiens Muscarinic acetylcholine receptor M5 IC50 nan None None
Homo sapiens Muscarinic acetylcholine receptor M5 Ki nan None None
Homo sapiens Neurokinin 1 receptor AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Neurokinin 1 receptor IC50 nan None None
Homo sapiens Neurokinin 1 receptor Ki nan None None
Homo sapiens Neurokinin 2 receptor IC50 nan None None
Homo sapiens Neurokinin 2 receptor Ki nan None None
Homo sapiens Neuronal acetylcholine receptor protein alpha-4 subunit AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Neuropeptide Y receptor type 1 AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Neuropeptide Y receptor type 1 IC50 nan None None
Homo sapiens Neuropeptide Y receptor type 1 Ki nan None None
Homo sapiens Neuropeptide Y receptor type 2 AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Neuropeptide Y receptor type 2 IC50 nan None None
Homo sapiens Neuropeptide Y receptor type 2 Ki nan None None
Homo sapiens Neurotensin receptor 1 AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Norepinephrine transporter AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Norepinephrine transporter IC50 nan None None
Homo sapiens Norepinephrine transporter Ki nan None None
Homo sapiens P-glycoprotein 1 Activity nan None 10.1016/s0024-3205(01)01494-1
Homo sapiens P-glycoprotein 1 Activity nan None 10.1023/a:1025032511040
Homo sapiens P-glycoprotein 1 Binding site fraction 0.2 None 10.1021/jm020941h
Homo sapiens P-glycoprotein 1 IC50 1300000.0 nM 10.1021/jm020941h
Homo sapiens P-glycoprotein 1 Ki 200000.0 nM 10.1021/jm020941h
Homo sapiens P-glycoprotein 1 Ki1 200.0 uM None
Homo sapiens P-glycoprotein 1 Ki2 1750.0 uM None
Homo sapiens P-glycoprotein 1 Papp 22.19 10'-6 cm/s 10.1016/j.ejmech.2015.10.040
Homo sapiens P-glycoprotein 1 Papp 23.69 10'-6 cm/s 10.1016/j.ejmech.2015.10.040
Homo sapiens P-glycoprotein 1 Ratio 1.07 None 10.1016/j.ejmech.2015.10.040
Homo sapiens Phosphodiesterase 3A AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Phosphodiesterase 4D AC50 4400.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Phosphodiesterase 5A IC50 nan None None
Homo sapiens Phosphodiesterase 5A Ki nan None None
Homo sapiens Plasma K(p,uu,CSF) 0.93 None 10.1021/jm901036q
Homo sapiens Platelet activating factor receptor IC50 nan None None
Homo sapiens Platelet activating factor receptor Ki nan None None
Homo sapiens Progesterone receptor AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Protein kinase C alpha IC50 nan None None
Homo sapiens Protein kinase C alpha Ki nan None None
Homo sapiens Receptor protein-tyrosine kinase erbB-2 IC50 nan None None
Homo sapiens Receptor protein-tyrosine kinase erbB-2 Ki nan None None
Homo sapiens Serine/threonine protein phosphatase 2B catalytic subunit, alpha isoform IC50 nan None None
Homo sapiens Serine/threonine protein phosphatase 2B catalytic subunit, alpha isoform Ki nan None None
Homo sapiens Serotonin 1a (5-HT1a) receptor AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Serotonin 2a (5-HT2a) receptor AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Serotonin 2a (5-HT2a) receptor AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Serotonin 2a (5-HT2a) receptor IC50 nan None None
Homo sapiens Serotonin 2a (5-HT2a) receptor Ki nan None None
Homo sapiens Serotonin 2b (5-HT2b) receptor AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Serotonin 2b (5-HT2b) receptor IC50 nan None None
Homo sapiens Serotonin 2b (5-HT2b) receptor Ki nan None None
Homo sapiens Serotonin 2c (5-HT2c) receptor AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Serotonin 2c (5-HT2c) receptor IC50 nan None None
Homo sapiens Serotonin 2c (5-HT2c) receptor Ki nan None None
Homo sapiens Serotonin 3a (5-HT3a) receptor AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Serotonin 6 (5-HT6) receptor IC50 nan None None
Homo sapiens Serotonin 6 (5-HT6) receptor Ki nan None None
Homo sapiens Serotonin transporter AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Serotonin transporter IC50 nan None None
Homo sapiens Serotonin transporter Ki nan None None
Homo sapiens Serum albumin Log B/F 0.807 None 10.1021/jm00179a017
Homo sapiens Serum albumin Log K' 0.29 None 10.1021/jm010960b
Homo sapiens Sigma opioid receptor IC50 nan None None
Homo sapiens Sigma opioid receptor Ki nan None None
Homo sapiens Skin log Kp -6.76 None 10.1016/j.bmc.2007.07.050
Homo sapiens Skin log Pe -0.6 None 10.1016/j.bmcl.2009.11.039
Homo sapiens SK-MEL-28 IC50 100000.0 nM 10.1016/j.bmc.2020.115404
Homo sapiens SK-MEL-28 Inhibition 30.0 % 10.1016/j.bmc.2020.115404
Homo sapiens SK-MEL-5 IC50 100000.0 nM 10.1016/j.bmc.2020.115404
Homo sapiens SK-MEL-5 Inhibition 38.8 % 10.1016/j.bmc.2020.115404
Homo sapiens Sodium channel alpha subunits; brain (Types I, II, III) IC50 117000.0 nM 10.1021/jm00381a019
Homo sapiens Sodium channel alpha subunits; brain (Types I, II, III) Inhibition 14.0 % 10.1021/jm00381a019
Homo sapiens Sodium channel alpha subunits; brain (Types I, II, III) Inhibition 47.3 % 10.1021/jm00381a019
Homo sapiens Sodium channel protein type V alpha subunit AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Solute carrier family 22 member 1 Inhibition 32.4 % 10.1021/jm8003152
Homo sapiens Solute carrier family 22 member 2 Activity nan None 10.1038/sj.bjp.0703518
Homo sapiens Solute carrier organic anion transporter family member 1B1 Inhibition 28.1 % 10.1021/jm300212s
Homo sapiens Solute carrier organic anion transporter family member 1B3 Inhibition 19.8 % 10.1021/jm300212s
Homo sapiens Solute carrier organic anion transporter family member 2B1 Inhibition 30.5 % 10.1021/jm300212s
Homo sapiens Thromboxane A2 receptor AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Thromboxane-A synthase IC50 nan None None
Homo sapiens Thromboxane-A synthase Ki nan None None
Homo sapiens Type-1 angiotensin II receptor AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Tyrosine-protein kinase FYN IC50 nan None None
Homo sapiens Tyrosine-protein kinase FYN Ki nan None None
Homo sapiens Tyrosine-protein kinase LCK IC50 nan None None
Homo sapiens Tyrosine-protein kinase LCK Ki nan None None
Homo sapiens Vascular endothelial growth factor receptor 1 IC50 nan None None
Homo sapiens Vascular endothelial growth factor receptor 1 Ki nan None None
Homo sapiens Vasoactive intestinal polypeptide receptor 1 IC50 nan None None
Homo sapiens Vasoactive intestinal polypeptide receptor 1 Ki nan None None
Homo sapiens Vasopressin V1a receptor AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Vasopressin V1a receptor IC50 nan None None
Homo sapiens Vasopressin V1a receptor Ki nan None None
Homo sapiens Vasopressin V2 receptor AC50 30000.0 nM 10.1038/s41467-023-40064-9
Mus musculus Beta-1 adrenergic receptor Ki 49.0 nM 10.1016/j.bmc.2019.05.034
Mus musculus Jejunum permeability 0.5 10'-4 cm/s 10.1124/dmd.112.049239
Mus musculus Nitric oxide synthase, inducible IC50 nan None None
Mus musculus Nitric oxide synthase, inducible Ki nan None None
Oryctolagus cuniculus Angiotensin-converting enzyme IC50 nan None None
Oryctolagus cuniculus Angiotensin-converting enzyme Ki nan None None
Oryctolagus cuniculus Arachidonate 15-lipoxygenase IC50 nan None None
Oryctolagus cuniculus Arachidonate 15-lipoxygenase Ki nan None None
Rattus norvegicus Adrenergic receptor beta ED30 1000.0 ug kg-1 10.1021/jm00365a005
Rattus norvegicus Adrenergic receptor beta ED30 1000.0 ug kg-1 10.1021/jm00370a012
Rattus norvegicus Adrenergic receptor beta IC50 500.0 nM 10.1016/S0960-894X(97)00207-2
Rattus norvegicus Aldose reductase IC50 nan None None
Rattus norvegicus Aldose reductase Ki nan None None
Rattus norvegicus Alpha-1a adrenergic receptor IC50 nan None None
Rattus norvegicus Alpha-1a adrenergic receptor Ki nan None None
Rattus norvegicus Alpha-1b adrenergic receptor IC50 nan None None
Rattus norvegicus Alpha-1b adrenergic receptor Ki nan None None
Rattus norvegicus Androgen Receptor AC50 30000.0 nM 10.1038/s41467-023-40064-9
Rattus norvegicus Androgen Receptor IC50 nan None None
Rattus norvegicus Androgen Receptor Ki nan None None
Rattus norvegicus Beta-1 adrenergic receptor ED50 0.25 mg.kg-1 10.1021/jm00365a005
Rattus norvegicus Beta-1 adrenergic receptor ED50 0.25 mg.kg-1 10.1021/jm00370a012
Rattus norvegicus Beta-1 adrenergic receptor Kd 22.91 nM 10.1021/acs.jmedchem.6b00472
Rattus norvegicus Beta-1 adrenergic receptor Kd 22.91 nM 10.1021/jm00389a008
Rattus norvegicus Beta-1 adrenergic receptor Ki 398.11 nM 10.1021/jm050624l
Rattus norvegicus Beta-1 adrenergic receptor Ki 630.96 nM 10.1021/jm050624l
Rattus norvegicus Beta-1 adrenergic receptor Ki 2511.89 nM 10.1021/jm050624l
Rattus norvegicus Beta-1 adrenergic receptor Ki 5011.87 nM 10.1021/jm050624l
Rattus norvegicus Brain Fu 0.46 None 10.1124/dmd.110.035998
Rattus norvegicus Brain Kp 2.53 None 10.1124/dmd.110.035998
Rattus norvegicus Brain Vd 5.5 L.kg-1 10.1124/dmd.110.035998
Rattus norvegicus Brain Vdu 5.5 ml 10.1021/jm901036q
Rattus norvegicus Cyclooxygenase-1 AC50 30000.0 nM 10.1038/s41467-023-40064-9
Rattus norvegicus GABA receptor alpha-1 subunit AC50 10000.0 nM 10.1038/s41467-023-40064-9
Rattus norvegicus Glutamate (NMDA) receptor subunit zeta 1 AC50 10000.0 nM 10.1038/s41467-023-40064-9
Rattus norvegicus Glycine receptor IC50 nan None None
Rattus norvegicus Glycine receptor Ki nan None None
Rattus norvegicus H9c2 Activity nan None 10.1016/j.ejmech.2022.114848
Rattus norvegicus Insulin receptor IC50 nan None None
Rattus norvegicus Insulin receptor Ki nan None None
Rattus norvegicus Liver CL 1.13 mL.min-1.g-1 10.1124/dmd.110.036806
Rattus norvegicus Liver CL 1.8 mL.min-1.g-1 10.1124/dmd.110.036806
Rattus norvegicus Liver ERH 0.72 None 10.1124/dmd.110.036806
Rattus norvegicus Liver ERH 0.84 None 10.1124/dmd.110.036806
Rattus norvegicus Liver K 1.78 None 10.1124/dmd.110.036806
Rattus norvegicus Liver K 2.27 None 10.1124/dmd.110.036806
Rattus norvegicus Liver K 9.64 None 10.1124/dmd.110.036806
Rattus norvegicus Liver K 11.97 None 10.1124/dmd.110.036806
Rattus norvegicus Liver MTT 60.26 s 10.1124/dmd.110.036806
Rattus norvegicus Liver MTT 67.43 s 10.1124/dmd.110.036806
Rattus norvegicus Liver permeability 7.59 ml/min 10.1124/dmd.110.036806
Rattus norvegicus Liver permeability 13.43 ml/min 10.1124/dmd.110.036806
Rattus norvegicus Nitric-oxide synthase, brain IC50 nan None None
Rattus norvegicus Nitric-oxide synthase, brain Ki nan None None
Rattus norvegicus Plasma Cp(f) 0.75 uM 10.1021/jm901036q
Rattus norvegicus Plasma Fu 0.88 None 10.1021/jm901371v
Rattus norvegicus Plasma Fu 0.9 None 10.1021/jm901036q
Rattus norvegicus Plasma K(p,uu,CSF) 0.43 None 10.1021/jm901036q
Rattus norvegicus Plasma logFu 0.89 None 10.1016/j.ejmech.2009.06.004
Rattus norvegicus Rattus norvegicus Activity 93.2 % 10.1021/jm00396a009
Rattus norvegicus Rattus norvegicus ALB 36300.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALB 37000.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALB 38000.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALB 38300.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALB 38700.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALB 39000.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALB 40000.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALB 42700.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALB 43200.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALB 43300.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALP 311.67 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALP 321.67 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALP 337.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALP 354.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALP 368.67 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALP 371.67 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALP 374.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALP 379.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALP 394.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALP 404.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALP 427.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALP 431.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALP 440.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALP 469.67 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALT 25.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALT 28.67 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALT 29.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALT 32.67 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALT 33.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALT 35.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALT 35.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALT 37.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALT 41.67 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALT 48.5 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALT 52.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALT 53.17 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALT 53.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALT 53.67 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus AST 59.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus AST 60.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus AST 61.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus AST 64.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus AST 65.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus AST 68.67 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus AST 69.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus AST 71.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus AST 77.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus AST 79.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus AST 80.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus AST 83.17 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus AST 83.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus Baseline systolic BP -18.0 % 10.1021/jm00389a008
Rattus norvegicus Rattus norvegicus Baseline systolic BP -9.0 % 10.1021/jm00389a008
Rattus norvegicus Rattus norvegicus Baseline systolic BP -1.0 % 10.1021/jm00389a008
Rattus norvegicus Rattus norvegicus BASO 0.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BASO 0.0633 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BASO 0.0667 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BASO 0.0733 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BASO 0.0767 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BASO 0.09 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BASO 0.13 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BASOLE 0.0 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BASOLE 0.57 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BASOLE 0.6 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BASOLE 0.67 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BASOLE 0.93 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BASOLE 1.03 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BASOLE 1.07 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BILI 1.8 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BILI 2.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BILI 2.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BILI 2.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BILI 3.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BILI 3.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BILI 4.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BILI 4.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BUN 130.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BUN 133.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BUN 140.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BUN 156.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BUN 160.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BUN 163.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BUN 166.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BUN 173.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BUN 176.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHLORIDE 100.33 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHLORIDE 100.67 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHLORIDE 101.83 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHLORIDE 102.0 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHLORIDE 102.33 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHLORIDE 103.0 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHLORIDE 103.33 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHLORIDE 104.0 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHLORIDE 104.67 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHLORIDE 106.67 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHLORIDE 107.33 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHOL 506.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHOL 510.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHOL 596.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHOL 616.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHOL 623.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHOL 680.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHOL 686.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHOL 706.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHOL 713.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHOL 723.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHOL 740.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHOL 743.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHOL 826.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CK 168.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CK 184.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CK 199.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CK 205.67 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CK 213.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CK 216.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CK 228.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CK 229.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CK 256.67 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CK 276.17 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CK 304.67 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CK 325.17 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CK 338.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CK 364.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CO2 22330000.0 nM 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CO2 25000000.0 nM 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CO2 27330000.0 nM 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CO2 27670000.0 nM 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CO2 28670000.0 nM 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CO2 34670000.0 nM 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CO2 38330000.0 nM 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CO2 38670000.0 nM 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CO2 40670000.0 nM 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CO2 44670000.0 nM 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CO2 45000000.0 nM 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CO2 45670000.0 nM 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CREAT 1.4 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CREAT 1.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CREAT 1.8 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CREAT 2.1 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CREAT 2.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CREAT 2.5 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CREAT 3.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CREAT 3.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CREAT 4.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CREAT 4.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOS 0.06 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOS 0.0667 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOS 0.09 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOS 0.12 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOS 0.15 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOS 0.23 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOS 0.38 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOS 67.33 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOS 97.33 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOS 118.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOS 151.33 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOS 248.67 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOS 286.33 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOSLE 0.43 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOSLE 0.5 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOSLE 0.6 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOSLE 0.67 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOSLE 0.83 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOSLE 0.9 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOSLE 1.0 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOSLE 1.03 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOSLE 1.33 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOSLE 1.67 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOSLE 2.33 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOSLE 3.13 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOSLE 4.2 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus GLUC 1566.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus GLUC 1603.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus GLUC 1613.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus GLUC 1635.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus GLUC 1636.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus GLUC 1640.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus GLUC 1650.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus GLUC 1680.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus GLUC 1720.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus GLUC 1780.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus GLUC 1800.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus GLUC 1833.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HCT 32.87 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HCT 33.73 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HCT 35.35 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HCT 35.87 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HCT 35.9 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HCT 36.35 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HCT 38.37 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HCT 40.47 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HCT 41.53 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HCT 42.13 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HCT 42.5 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HCT 43.27 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HCT 44.17 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HCT 45.37 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HGB 124300.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HGB 125000.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HGB 128000.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HGB 128300.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HGB 132200.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HGB 134700.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HGB 135800.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HGB 136000.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HGB 137000.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HGB 141000.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HGB 141700.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HGB 144000.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HGB 147300.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HGB 149700.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LDH 77.67 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LDH 84.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LDH 88.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LDH 97.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LDH 102.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LDH 103.67 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LDH 114.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LDH 123.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LDH 126.67 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LDH 144.67 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LDH 229.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LDH 254.83 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LDH 274.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LDH 430.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LIPASE 8.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LIPASE 8.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LIPASE 8.67 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LIPASE 8.83 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LIPASE 10.67 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LIPASE 13.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LIPASE 14.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LIPASE 16.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LIPASE 18.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYM 5.15 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYM 7.01 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYM 8.01 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYM 8.23 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYM 8.65 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYM 9.51 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYM 10.87 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYM 10.9 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYM 5879.33 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYM 8523.67 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYM 10599.5 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYM 10653.33 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYM 11270.67 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYM 12977.83 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYMLE 69.3 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYMLE 70.57 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYMLE 74.4 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYMLE 75.5 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYMLE 78.7 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYMLE 78.87 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYMLE 79.03 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYMLE 81.03 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYMLE 87.33 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYMLE 89.0 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYMLE 90.33 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYMLE 90.5 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYMLE 91.0 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYMLE 93.0 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCH 20.5 pg 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCH 20.53 pg 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCH 20.87 pg 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCH 21.23 pg 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCH 21.27 pg 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCH 21.3 pg 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCH 21.87 pg 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCH 22.77 pg 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCH 23.32 pg 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCH 23.88 pg 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCH 24.2 pg 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCH 24.57 pg 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCH 24.7 pg 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCHC 317300.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCHC 319000.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCHC 322700.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCHC 325000.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCHC 330000.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCHC 338000.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCHC 340700.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCHC 341300.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCHC 374000.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCHC 374200.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCHC 375000.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCHC 378300.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCHC 379300.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCHC 382000.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCV 60.1 fL 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCV 60.63 fL 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCV 61.17 fL 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCV 62.42 fL 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCV 63.4 fL 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCV 63.85 fL 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCV 64.57 fL 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCV 64.63 fL 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCV 64.67 fL 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCV 64.7 fL 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCV 65.23 fL 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCV 65.33 fL 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCV 65.47 fL 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCV 66.0 fL 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONO 0.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONO 0.22 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONO 0.24 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONO 0.25 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONO 0.27 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONO 0.29 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONO 0.32 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONO 14.67 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONO 19.67 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONO 40.33 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONO 109.5 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONOLE 0.0 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONOLE 0.17 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONOLE 0.33 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONOLE 1.0 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONOLE 1.33 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONOLE 2.0 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONOLE 2.5 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONOLE 2.6 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONOLE 2.73 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONOLE 2.8 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONOLE 2.97 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTLE 5.33 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTLE 7.33 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTLE 7.67 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTLE 8.33 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTLE 9.17 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTLE 11.33 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTLE 14.33 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTLE 16.1 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTLE 17.07 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTLE 17.47 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTLE 20.17 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTLE 20.5 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTLE 21.47 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTLE 23.23 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTSG 342.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTSG 775.67 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTSG 909.67 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTSG 1137.17 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTSG 1139.67 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTSG 1388.33 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PHOS 92.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PHOS 102.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PHOS 107.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PHOS 107.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PHOS 110.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PHOS 111.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PHOS 113.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PHOS 116.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PHOS 116.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PHOS 117.2 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PHOS 120.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PHOS 121.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PHOS 123.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PHOS 133.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PLAT 1007000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PLAT 1018670.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PLAT 1067000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PLAT 1162000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PLAT 1170000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PLAT 1179330.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PLAT 1228670.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PLAT 1260000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PLAT 1269000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PLAT 1279330.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PLAT 1290670.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PLAT 1297000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PLAT 1333330.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PLAT 1337670.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus POTASSIUM 5.3 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus POTASSIUM 5.99 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus POTASSIUM 6.17 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus POTASSIUM 6.24 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus POTASSIUM 6.28 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus POTASSIUM 6.31 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus POTASSIUM 6.47 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus POTASSIUM 6.5 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus POTASSIUM 6.57 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus POTASSIUM 6.67 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus POTASSIUM 6.83 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus POTASSIUM 6.87 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus POTASSIUM 7.13 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PROT 55700.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PROT 56000.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PROT 59000.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PROT 60300.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PROT 61000.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PROT 61200.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PROT 61300.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PROT 61700.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PROT 62000.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PROT 62700.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PROT 63000.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PROT 63300.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PROT 63700.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PROT 64300.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus RBC 5040000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus RBC 5220000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus RBC 5540000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus RBC 5660000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus RBC 5820000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus RBC 5880000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus RBC 5920000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus RBC 6250000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus RBC 6380000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus RBC 6580000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus RBC 6760000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus RBC 6790000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus RBC 7040000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus RBC 7200000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus RBCNUC 0.0 /100WBC 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus SODIUM 141.53 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus SODIUM 142.67 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus SODIUM 143.0 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus SODIUM 143.57 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus SODIUM 143.6 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus SODIUM 144.0 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus SODIUM 144.67 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus SODIUM 145.6 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus SODIUM 145.67 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus SODIUM 146.23 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus SODIUM 147.67 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus Tissue Severity Score nan None 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus URATE 0.667 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus URATE 1.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus URATE 6.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus URATE 8.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus URATE 8.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus URATE 8.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus URATE 9.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus URATE 9.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus URATE 12.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus URATE 13.8 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus URATE 17.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus URATE 17.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus URATE 17.8 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus WBC 6330.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus WBC 7410.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus WBC 9370.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus WBC 9830.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus WBC 10190.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus WBC 10390.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus WBC 11610.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus WBC 12000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus WBC 12200.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus WBC 12470.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus WBC 12580.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus WBC 13380.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus WBC 13770.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus WBC 14380.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Serotonin 1a (5-HT1a) receptor IC50 nan None None
Rattus norvegicus Serotonin 1a (5-HT1a) receptor Ki 10000.0 nM 10.1021/jm950410b
Rattus norvegicus Serotonin 1a (5-HT1a) receptor Ki nan None None
Rattus norvegicus Serotonin 1b (5-HT1b) receptor IC50 nan None None
Rattus norvegicus Serotonin 1b (5-HT1b) receptor Ki nan None None
Rattus norvegicus Small intestine Ka 2.3 /hr 10.1016/j.ejmech.2014.06.050
Rattus norvegicus Small intestine Peff 5.53 10'-5cm/s 10.1016/j.ejmech.2014.06.050
Rattus norvegicus Voltage-gated L-type calcium channel alpha-1C subunit AC50 10000.0 nM 10.1038/s41467-023-40064-9
Rattus norvegicus Voltage-gated N-type calcium channel alpha-1B subunit AC50 10000.0 nM 10.1038/s41467-023-40064-9
Severe acute respiratory syndrome coronavirus 2 SARS-CoV-2 IC50 19952.62 nM 10.6019/CHEMBL4651402
Severe acute respiratory syndrome coronavirus 2 SARS-CoV-2 IC50 20000.0 nM 10.6019/CHEMBL4651402
None ADMET Activity 0.154 % 10.1016/j.ejmech.2020.112465
None ADMET Activity 102.0 % 10.1021/jm048980b
None ADMET Activity 326.0 omegacm2 10.1016/j.ejmech.2020.112465
None ADMET Biotransformation nan None 10.1038/s41586-019-1291-3
None ADMET BPR 3.14 None 10.1021/jm901036q
None ADMET CL 8.41 uL.min-1.(10^6cells)-1 10.1124/dmd.111.042309
None ADMET CL 13.0 mL.min-1.kg-1 10.1124/dmd.108.020479
None ADMET CL 15.0 mL.min-1.kg-1 10.1002/jps.20373
None ADMET CL 23.0 mL.min-1.kg-1 10.1002/jps.20373
None ADMET CL 30.0 mL.min-1.kg-1 10.1002/jps.20373
None ADMET CL 46.5 mL.min-1.kg-1 10.1124/dmd.111.042309
None ADMET CL 185.0 mL.min-1.kg-1 10.1002/jps.20373
None ADMET CLH 4.35 uL/min 10.1016/j.ejmech.2020.112465
None ADMET delta logD -0.9 None 10.1021/jm0000564
None ADMET DNAUC 8.33 kg.min/L 10.1080/00498250400028197
None ADMET DNAUC 15.8 kg.min/L 10.1080/00498250400028197
None ADMET DNAUC 25.33 kg.min/L 10.1080/00498250400028197
None ADMET DNAUC 58.0 kg.min/L 10.1080/00498250400028197
None ADMET Drug recovery 90.4 % 10.1016/j.ejmech.2021.113232
None ADMET Drug recovery 90.7 % 10.1016/j.ejmech.2021.113232
None ADMET eLog D -0.62 None 10.1021/jm0200409
None ADMET F 38.0 % 10.1021/jm010152k
None ADMET F 49.0 % 10.1021/jm0000564
None ADMET F 102.0 % None
None ADMET FA 100.0 % 10.1021/jm049711o
None ADMET Fraction ionised 0.995 None 10.1021/jm0200409
None ADMET Fu 0.084 None 10.1021/jm0200409
None ADMET Fu 0.8 None 10.1124/dmd.111.042309
None ADMET Fu 0.89 None 10.1021/jm0200409
None ADMET Fu 0.89 None 10.1021/jm030408h
None ADMET K(p,uu,brain) 0.64 None 10.1021/jm901036q
None ADMET LD50 118.0 mg.kg-1 10.1016/S0960-894X(97)00046-2
None ADMET LD50 292.1 mg.kg-1 10.1016/S0960-894X(97)00046-2
None ADMET LD50 2090.0 mg.kg-1 10.1016/S0960-894X(97)00046-2
None ADMET LD50 3060.6 mg.kg-1 10.1016/S0960-894X(97)00046-2
None ADMET logPapp -4.57 None 10.1124/dmd.111.041665
None ADMET logPapp -4.55 None 10.1124/dmd.111.041665
None ADMET LogP app -5.1 None 10.1016/j.bmc.2007.03.040
None ADMET LogP app -4.95 None 10.1016/j.bmc.2007.03.040
None ADMET LogP app -4.84 None 10.1016/j.bmc.2007.03.040
None ADMET Log Pe -4.2 cm s-1 10.1021/jm001020e
None ADMET Log Pe,max -3.6 None 10.1021/jm001020e
None ADMET logP(lung) 1.06 None 10.1016/j.ejmech.2007.04.002
None ADMET logPm -1.75 None 10.1016/j.bmc.2007.03.040
None ADMET Log Po -2.8 None 10.1021/jm001020e
None ADMET MRT 4.0 hr 10.1124/dmd.108.020479
None ADMET Papp 0.48 10^-6 cm/s 10.1016/j.ejmech.2022.114563
None ADMET Papp 1.47 10'-5cm/s 10.1016/j.bmc.2019.07.011
None ADMET Papp 3.23 10'-6 cm/s 10.1021/jm1015704
None ADMET Papp 8.6 cm/s * 10E6 10.1021/jm049711o
None ADMET Papp 13.6 ucm/s 10.1021/acs.jmedchem.9b00833
None ADMET Papp 14.35 10^-6 cm/s 10.1016/j.bmc.2007.03.040
None ADMET Papp 18.21 cm s-1 10.1021/jm049661n
None ADMET Papp 20.39 10'-6 cm/s 10.1021/acs.jmedchem.8b02032
None ADMET Papp 21.2 10^-6 cm/s 10.1016/j.ejmech.2021.113232
None ADMET Papp 25.94 ucm/s 10.1021/acs.jmedchem.8b00819
None ADMET Papp 26.9 10^-6 cm/s 10.1016/j.ejmech.2021.113232
None ADMET Papp 29.88 ucm/s 10.1016/j.bmcl.2012.10.126
None ADMET Papp 30.66 10'-6 cm/s 10.1021/acs.jmedchem.8b00613
None ADMET Papp 31.4 10^-6 cm/s 10.1016/j.ejmech.2022.114118
None ADMET Papp 32.6 10^-6 cm/s 10.1016/j.ejmech.2020.112465
None ADMET Papp 33.3 10^-6 cm/s 10.1016/j.ejmech.2022.114118
None ADMET Papp 35.19 ucm/s 10.1021/acs.jmedchem.8b00819
None ADMET Papp 37.18 10'-6 cm/s 10.1021/acs.jmedchem.8b02032
None ADMET Papp 37.78 cm s-1 10.1021/jm049661n
None ADMET Papp 39.29 10'-6 cm/s 10.1021/acs.jmedchem.8b00613
None ADMET Papp 40.0 10'-6 cm/s 10.1021/acs.jmedchem.8b00172
None ADMET Papp 55.0 10'-6 cm/s 10.1021/acs.jmedchem.8b00172
None ADMET Papp 86.0 cm/s * 10E6 10.1021/jm049711o
None ADMET Papp 91.0 cm/s * 10E6 10.1021/jm049711o
None ADMET Papp 140.0 nm/s 10.1021/acs.jmedchem.9b01886
None ADMET Papp 190.0 cm/s * 10E6 10.1021/jm049711o
None ADMET Papp 64000000.0 cm s-1 10.1021/jm001101a
None ADMET Papp e-6 27.0 cm s-1 10.1021/jm010152k
None ADMET Peff 2.3 10'-5cm/s 10.1016/j.ejmech.2014.06.050
None ADMET permeability 0.9 10'-4 cm/s 10.1021/jm901846t
None ADMET permeability 1.34 10'-4 cm/s 10.1124/dmd.112.049239
None ADMET permeability 10.2 10^-6 cm/s 10.1021/acs.jmedchem.1c00472
None ADMET permeability 36.0 10'-6 cm/s 10.1021/acs.jmedchem.7b00746
None ADMET permeability 83.5 10^-6 cm/s 10.1021/acs.jmedchem.1c00472
None ADMET permeability nan None 10.1016/j.bmc.2011.05.062
None ADMET pKa 9.6 None 10.1021/jm00179a017
None ADMET R 73.0 % 10.1021/jm010152k
None ADMET Ratio 0.55 None 10.1021/acs.jmedchem.8b02032
None ADMET Ratio 0.7 None 10.1021/acs.jmedchem.8b00172
None ADMET Ratio 0.74 None 10.1021/acs.jmedchem.8b00819
None ADMET Ratio 0.78 None 10.1021/acs.jmedchem.8b00613
None ADMET Ratio 0.79 None 10.1016/j.ejmech.2021.113232
None ADMET Ratio 1.0 None 10.1021/acsmedchemlett.9b00471
None ADMET Ratio 1.1 None 10.1016/j.ejmech.2022.114118
None ADMET T1/2 2.65 hr 10.1016/j.ejmech.2020.112465
None ADMET T1/2 3.0 hr 10.1021/acs.jmedchem.6b00472
None ADMET T1/2 3.6 hr 10.1124/dmd.108.020479
None ADMET Vdss 3.0 L.kg-1 10.1002/jps.20373
None ADMET Vdss 3.1 L.kg-1 10.1124/dmd.108.020479
None ADMET Vdss 3.73 L.kg-1 10.1021/jm030408h
None ADMET Vdss 4.2 L.kg-1 10.1002/jps.20373
None ADMET Vdss 4.2 L.kg-1 10.1021/jm0200409
None ADMET Vdss 4.5 L.kg-1 10.1002/jps.20373
None ADMET Vdss 7.0 mL/min/kg 10.1002/jps.20373
None Hepatotoxicity Alkaline Phosphatase Increase - Activity Score nan None 10.2174/1570163043334794
None Hepatotoxicity Alkaline Phosphatase Increase - Index Value 0.4 None 10.2174/1570163043334794
None Hepatotoxicity Alkaline Phosphatase Increase - Number of Reports 4.0 None 10.2174/1570163043334794
None Hepatotoxicity Composite Activity - Active 0.0 None 10.2174/1570163043334794
None Hepatotoxicity Composite Activity - Marginal 0.0 None 10.2174/1570163043334794
None Hepatotoxicity Composite Activity - Score nan None 10.2174/1570163043334794
None Hepatotoxicity GGT Increase - Activity Score nan None 10.2174/1570163043334794
None Hepatotoxicity GGT Increase - Index Value 0.0 None 10.2174/1570163043334794
None Hepatotoxicity GGT Increase - Number of Reports 4.0 None 10.2174/1570163043334794
None Hepatotoxicity Hepatotoxicity nan None 10.1021/tx900326k
None Hepatotoxicity HepSE_bilirubinemia 0.0 None 10.1371/journal.pcbi.1002310
None Hepatotoxicity HepSE_cholecystitis 0.0 None 10.1371/journal.pcbi.1002310
None Hepatotoxicity HepSE_cholelithiasis 0.0 None 10.1371/journal.pcbi.1002310
None Hepatotoxicity HepSE_cirrhosis 0.0 None 10.1371/journal.pcbi.1002310
None Hepatotoxicity HepSE_Combined Scores 2.0 None 10.1371/journal.pcbi.1002310
None Hepatotoxicity HepSE_elevated liver function tests 0.0 None 10.1371/journal.pcbi.1002310
None Hepatotoxicity HepSE_hepatic failure 0.0 None 10.1371/journal.pcbi.1002310
None Hepatotoxicity HepSE_hepatic necrosis 0.0 None 10.1371/journal.pcbi.1002310
None Hepatotoxicity HepSE_hepatitis 1.0 None 10.1371/journal.pcbi.1002310
None Hepatotoxicity HepSE_hepatomegaly 0.0 None 10.1371/journal.pcbi.1002310
None Hepatotoxicity HepSE_jaundice 1.0 None 10.1371/journal.pcbi.1002310
None Hepatotoxicity HepSE_liver disease 0.0 None 10.1371/journal.pcbi.1002310
None Hepatotoxicity HepSE_liver fatty 0.0 None 10.1371/journal.pcbi.1002310
None Hepatotoxicity HepSE_liver function tests abnormal 0.0 None 10.1371/journal.pcbi.1002310
None Hepatotoxicity LDH Increase - Activity Score nan None 10.2174/1570163043334794
None Hepatotoxicity LDH Increase - Index Value 0.3 None 10.2174/1570163043334794
None Hepatotoxicity LDH Increase - Number of Reports 4.0 None 10.2174/1570163043334794
None Hepatotoxicity LTKB_BD DILI severity score 5.0 None 10.1016/j.drudis.2011.05.007
None Hepatotoxicity SGOT Increase - Activity Score nan None 10.2174/1570163043334794
None Hepatotoxicity SGOT Increase - Index Value 0.5 None 10.2174/1570163043334794
None Hepatotoxicity SGOT Increase - Number of Reports 4.0 None 10.2174/1570163043334794
None Hepatotoxicity SGPT Increase - Activity Score nan None 10.2174/1570163043334794
None Hepatotoxicity SGPT Increase - Index Value 0.5 None 10.2174/1570163043334794
None Hepatotoxicity SGPT Increase - Number of Reports 4.0 None 10.2174/1570163043334794
None Liposome Other 82.0 None 10.1021/jm991156g
None Liposome Other 179.0 None 10.1021/jm991156g
None NON-PROTEIN TARGET Fu 0.88 None 10.1124/dmd.108.020479
None NON-PROTEIN TARGET Fu 0.974 None 10.1124/dmd.111.042309
None NON-PROTEIN TARGET Fu 1.0 None 10.1021/jm401963n
None NON-PROTEIN TARGET Hepatotoxicity (acute) 0.0 % 10.1016/s0399-8320(04)95062-2
None NON-PROTEIN TARGET Hepatotoxicity (animal toxicity known) nan None 10.1016/s0399-8320(04)95062-2
None NON-PROTEIN TARGET Hepatotoxicity (benign tumour) 0.0 None 10.1016/s0399-8320(04)95062-2
None NON-PROTEIN TARGET Hepatotoxicity (granulomatous hepatitis) 0.0 None 10.1016/s0399-8320(04)95062-2
None NON-PROTEIN TARGET Hepatotoxicity (mechanism) nan None 10.1016/s0399-8320(04)95062-2
None NON-PROTEIN TARGET Hepatotoxicity (moderate) 3.0 None 10.1016/s0399-8320(04)95062-2
None NON-PROTEIN TARGET Hepatotoxicity (moderate) 32.0 % 10.1016/s0399-8320(04)95062-2
None NON-PROTEIN TARGET Hepatotoxicity (time to onset) nan None 10.1016/s0399-8320(04)95062-2
None No relevant target Daq 7.9 10'-6cm2/s 10.1021/jm901846t
None No relevant target Lipophilicity 0.01 None 10.1021/jm00389a008
None No relevant target LogD -2.46 None 10.1016/j.ejmech.2017.01.011
None No relevant target LogD -1.32 None 10.1021/jm0000564
None No relevant target LogD -0.81 None 10.1016/j.bmcl.2009.11.039
None No relevant target LogD -0.8 None 10.1021/jm001020e
None No relevant target LogD -0.76 None 10.1016/j.ejmech.2017.01.011
None No relevant target LogD -0.42 None 10.1021/jm980313t
None No relevant target LogD -0.37 None 10.1016/j.ejmech.2017.01.011
None No relevant target LogD -0.24 None 10.1124/dmd.111.041665
None No relevant target LogD -0.16 None 10.1021/jm0100990
None No relevant target LogD -0.1 None 10.1021/acs.jmedchem.5b00201
None No relevant target LogD 0.05 None 10.1016/j.ejmech.2021.113630
None No relevant target LogD 0.07 None 10.1021/jm970530e
None No relevant target LogD 0.07 None 10.1124/dmd.111.041665
None No relevant target LogD 0.24 None 10.1021/jf102525e
None No relevant target LogD7.4 1.79 None 10.1124/dmd.110.036806
None No relevant target log K -0.27 None 10.1021/jm9003945
None No relevant target log K 1.1 None 10.1021/jm9003945
None No relevant target Log Kmemb -1.6 None 10.1021/jm0309001
None No relevant target LogP -0.4 None 10.1021/jm001020e
None No relevant target LogP 1.88 None 10.1016/j.bmc.2007.03.040
None No relevant target LogP 1.88 None 10.1021/jf102525e
None No relevant target LogP 1.88 None 10.1021/jm801441s
None No relevant target LogP 1.93 None 10.1124/dmd.111.042309
None No relevant target LogP 1.95 None 10.1021/jm7014809
None No relevant target LogP 1.95 None 10.1021/jm9003945
None No relevant target LogP 1.95 None 10.1021/jm901846t
None No relevant target LogP 2.08 None 10.1021/jm801441s
None No relevant target LogP 2.2 None 10.1021/jm7014809
None No relevant target LogP 2.34 None 10.1021/jm00179a017
None No relevant target logPapp -5.1 None 10.1021/jf102525e
None No relevant target logPc -1.1 None 10.1021/jm9003945
None No relevant target Log PNalk -0.38 None 10.1021/jm048980b
None No relevant target Peff 40.4 nm/s 10.1021/acs.jmedchem.8b00286
None No relevant target pKa 2.45 None 10.1021/jf102525e
None No relevant target pKa 6.55 None 10.1016/j.bmc.2007.03.040
None No relevant target pKa 9.17 None 10.1124/dmd.110.036806
None No relevant target pKa 9.18 None 10.1021/jm020941h
None No relevant target pKa 9.18 None 10.1021/jm901846t
None No relevant target pKa 9.56 None 10.1007/s11095-013-1232-z
None No relevant target pKa 9.63 None 10.1021/jm9003945
None No relevant target pKa 9.7 None 10.1007/s11095-013-1232-z
None No relevant target pKa 9.7 None 10.1016/j.ejmech.2009.06.004
None No relevant target pKa 9.7 None 10.1021/jm0000564
None No relevant target pKa 9.7 None 10.1021/jm0200409
None No relevant target pKa 9.7 None 10.1021/jm030408h
None No relevant target pKa 9.7 None 10.1021/jm980313t
None No relevant target pKa 9.7 None 10.1124/dmd.110.035998
None No relevant target pKa 9.7 None 10.1124/dmd.111.042309
None No relevant target pKa 13.74 None 10.1124/dmd.112.050278
None No relevant target solubility nan None 10.1021/acs.jmedchem.8b00613
None No relevant target Solubility 180800.0 nM 10.1021/acs.jmedchem.9b00062
None No relevant target Solubility 200000.0 nM 10.1016/j.ejmech.2022.114218
None Phospholipidosis Phospholipidosis nan None 10.1080/15376510701857262
None Unchecked AAL -1.07 None 10.1021/jm00389a008
None Unchecked Activity 70.0 % 10.1021/np50094a001
None Unchecked APDc 42.47 None 10.6019/CHEMBL4295262
None Unchecked APDc 43.18 None 10.6019/CHEMBL4295262
None Unchecked APDc 43.54 None 10.6019/CHEMBL4295262
None Unchecked APDc 55.84 None 10.6019/CHEMBL4295262
None Unchecked FPDc 0.03258 None 10.6019/CHEMBL4295262
None Unchecked FPDc 0.03359 None 10.6019/CHEMBL4295262
None Unchecked FPDc 0.03613 None 10.6019/CHEMBL4295262
None Unchecked FPDc 53.88 None 10.6019/CHEMBL4295262
None Unchecked FPDc 54.76 None 10.6019/CHEMBL4295262
None Unchecked FPDc 55.07 None 10.6019/CHEMBL4295262
None Unchecked FPDc 61.11 None 10.6019/CHEMBL4295262
None Unchecked FPDc 68.0 None 10.6019/CHEMBL4295262
None Unchecked FPDc 71.03 None 10.6019/CHEMBL4295262
None Unchecked FPDc 72.23 None 10.6019/CHEMBL4295262
None Unchecked FPDc 74.38 None 10.6019/CHEMBL4295262
None Unchecked FPDc nan None 10.6019/CHEMBL4295262
None Unchecked FPD measurement 0.03258 FPDc 10.6019/CHEMBL4295262
None Unchecked FPD measurement 0.03359 FPDc 10.6019/CHEMBL4295262
None Unchecked FPD measurement 0.03613 FPDc 10.6019/CHEMBL4295262
None Unchecked FPD measurement 42.47 FPDc 10.6019/CHEMBL4295262
None Unchecked FPD measurement 43.18 FPDc 10.6019/CHEMBL4295262
None Unchecked FPD measurement 43.54 FPDc 10.6019/CHEMBL4295262
None Unchecked FPD measurement 53.88 FPDc 10.6019/CHEMBL4295262
None Unchecked FPD measurement 54.76 FPDc 10.6019/CHEMBL4295262
None Unchecked FPD measurement 55.07 FPDc 10.6019/CHEMBL4295262
None Unchecked FPD measurement 55.84 FPDc 10.6019/CHEMBL4295262
None Unchecked FPD measurement 71.03 FPDc 10.6019/CHEMBL4295262
None Unchecked FPD measurement nan None 10.6019/CHEMBL4295262
None Unchecked Hepatotoxicity (acute) 1.0 None 10.1016/s0399-8320(04)95062-2
None Unchecked Hepatotoxicity (association with vascular disease) 0.0 None 10.1016/s0399-8320(04)95062-2
None Unchecked Hepatotoxicity (choleostasis) 0.0 None 10.1016/s0399-8320(04)95062-2
None Unchecked Hepatotoxicity (chronic liver disease) 0.0 None 10.1016/s0399-8320(04)95062-2
None Unchecked Hepatotoxicity (cirrhosis) 0.0 None 10.1016/s0399-8320(04)95062-2
None Unchecked Hepatotoxicity (comment) nan None 10.1016/s0399-8320(04)95062-2
None Unchecked Hepatotoxicity (cytolytic) 1.0 None 10.1016/s0399-8320(04)95062-2
None Unchecked Hepatotoxicity (malignant tumour) 0.0 None 10.1016/s0399-8320(04)95062-2
None Unchecked Hepatotoxicity (severe hepatitis) 0.0 None 10.1016/s0399-8320(04)95062-2
None Unchecked Hepatotoxicity (steatosis) 0.0 None 10.1016/s0399-8320(04)95062-2
None Unchecked Hepatotoxicity (successful reintroduction) nan None 10.1016/s0399-8320(04)95062-2
None Unchecked IC50 1000000.0 nM 10.1021/jm401090a
None Unchecked IC50 nan None None
None Unchecked Ki 45.0 nM 10.1021/np50094a001
None Unchecked Ki nan None 10.1016/j.bmc.2019.05.034
None Unchecked Ki nan None None
None Unchecked Ratio 0.59 None 10.1016/S0960-894X(97)00207-2
None Unchecked Ratio Ki 4.5 None 10.1016/j.bmc.2019.05.034
None Unchecked Selectivity 31.62 None 10.1021/jm00389a008

Metabolism Information