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clonidine (imino form)

AlkaPlorer ID: AK084432

Synonym: None

IUPAC Name: N-(2,6-dichlorophenyl)-4,5-dihydro-1H-imidazol-2-amine

Structure

SMILES: ClC1=CC=CC(Cl)=C1NC1=NCCN1

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InChI: InChI=1S/C9H9Cl2N3/c10-6-2-1-3-7(11)8(6)14-9-12-4-5-13-9/h1-3H,4-5H2,(H2,12,13,14)

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InChIKey: GJSURZIOUXUGAL-UHFFFAOYSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain

Properties Information

Molecule Weight: 230.098

TPSA？: 36.42

MolLogP？: 2.3645

Number of H-Donors: 2

Number of H-Acceptors: 3

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
Bos taurus Alpha-1a adrenergic receptor EC50 89.0 nM None
Bos taurus Alpha-1a adrenergic receptor Emax 62.0 % None
Bos taurus Alpha-2a adrenergic receptor IC50 2.0 nM 10.1021/jm00123a039
Bos taurus Progesterone receptor IC50 nan None None
Bos taurus Progesterone receptor Ki nan None None
Canis lupus familiaris Canis familiaris DOSE 0.25 mg.kg-1 10.1021/jm00186a019
Canis lupus familiaris Canis familiaris DOSE 0.3 mg.kg-1 10.1021/jm00186a019
Cavia porcellus Beta-1 adrenergic receptor Kd 39810.72 nM 10.1021/jm00115a008
Cavia porcellus Beta-1 adrenergic receptor Kd 63095.73 nM 10.1021/jm00115a008
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
Cercopithecidae Monkey DOSE 0.7 mg.kg-1 10.1021/jm00186a019
Cricetulus griseus Alpha-1B adrenergic receptor EC50 83.0 nM None
Cricetulus griseus Alpha-1B adrenergic receptor Emax 63.0 % None
Cryptosporidium parvum Cryptosporidium parvum IC50 nan None 10.1016/j.bmc.2010.01.068
Danio rerio Danio rerio Activity nan None 10.1038/nchembio.79
Entamoeba histolytica Entamoeba histolytica IC50 nan None 10.1016/j.bmc.2010.01.068
Equus caballus Ferritin light chain Potency 5011.9 nM None
Felis catus Felis catus Activity -26.0 mmHg 10.1016/j.bmcl.2010.12.062
Felis catus Felis catus Activity -15.0 bpm 10.1016/j.bmcl.2010.12.062
Felis catus Felis catus Activity -15.0 mmHg 10.1016/j.bmcl.2010.12.062
Felis catus Felis catus Activity -8.0 bpm 10.1016/j.bmcl.2010.12.062
Felis catus Felis catus pC20 8.72 None 10.1021/jm00352a003
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 alpha-1 EC50 290.0 nM 10.1021/jm960359r
Homo sapiens Adrenergic receptor alpha-1 Ki 510.0 nM 10.1021/jm960012o
Homo sapiens Adrenergic receptor alpha-1 Ki 510.0 nM 10.1021/jm960359r
Homo sapiens Adrenergic receptor alpha-2 Activity nan None 10.1021/jm021050c
Homo sapiens Adrenergic receptor alpha-2 EC50 4.4 nM 10.1021/jm960359r
Homo sapiens Adrenergic receptor alpha-2 EC50 35.3 nM 10.1016/j.ejmech.2016.03.026
Homo sapiens Adrenergic receptor alpha-2 IC50 21.0 nM 10.1021/jm00390a021
Homo sapiens Adrenergic receptor alpha-2 Intrinsic activity 1.0 None 10.1021/jm00115a008
Homo sapiens Adrenergic receptor alpha-2 Intrinsic activity 50.0 % 10.1016/j.ejmech.2016.03.026
Homo sapiens Adrenergic receptor alpha-2 Ki 3.8 nM 10.1021/jm501456p
Homo sapiens Adrenergic receptor alpha-2 Ki 20.89 nM 10.1021/jm070229q
Homo sapiens Adrenergic receptor alpha-2 Ki 20.89 nM 10.1021/jm800838r
Homo sapiens Adrenergic receptor alpha-2 pD2 7.8 None 10.1016/S0960-894X(96)00518-5
Homo sapiens Adrenergic receptor alpha-2 pD2 8.7 None 10.1021/jm00115a008
Homo sapiens Alpha-1a adrenergic receptor AC50 1.7 nM 10.1038/s41467-023-40064-9
Homo sapiens Alpha-1a adrenergic receptor AC50 8.3 nM 10.1038/s41467-023-40064-9
Homo sapiens Alpha-1a adrenergic receptor AC50 214.9 nM 10.1038/s41467-023-40064-9
Homo sapiens Alpha-1a adrenergic receptor Ki 512.86 nM 10.1016/0960-894X(94)85032-1
Homo sapiens Alpha-1a adrenergic receptor Ki 977.24 nM 10.1016/0960-894X(94)85032-1
Homo sapiens Alpha-1b adrenergic receptor Ki 416869383470336.4 nM 10.1016/0960-894X(94)85032-1
Homo sapiens Alpha-1d adrenergic receptor IC50 1210.0 nM None
Homo sapiens Alpha-1d adrenergic receptor Ki 595.0 nM None
Homo sapiens Alpha-2a adrenergic receptor AC50 35.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Alpha-2a adrenergic receptor AC50 48.1 nM 10.1038/s41467-023-40064-9
Homo sapiens Alpha-2a adrenergic receptor AC50 301.7 nM 10.1038/s41467-023-40064-9
Homo sapiens Alpha-2a adrenergic receptor Activity nan None 10.1038/nchembio705
Homo sapiens Alpha-2a adrenergic receptor EC50 8.128 nM 10.1016/0960-894X(94)85032-1
Homo sapiens Alpha-2a adrenergic receptor EC50 8.318 nM 10.1021/jm100977d
Homo sapiens Alpha-2a adrenergic receptor EC50 10.0 nM None
Homo sapiens Alpha-2a adrenergic receptor EC50 28.0 nM 10.1016/j.bmc.2010.11.020
Homo sapiens Alpha-2a adrenergic receptor EC50 30.0 nM 10.1016/j.bmc.2011.11.025
Homo sapiens Alpha-2a adrenergic receptor EC50 30.2 nM 10.1016/j.bmc.2016.05.043
Homo sapiens Alpha-2a adrenergic receptor Emax 51.0 % 10.1016/j.bmc.2011.11.025
Homo sapiens Alpha-2a adrenergic receptor Emax 94.0 % None
Homo sapiens Alpha-2a adrenergic receptor IC50 280.0 nM None
Homo sapiens Alpha-2a adrenergic receptor Intrinsic activity 0.9 None 10.1021/jm100977d
Homo sapiens Alpha-2a adrenergic receptor Intrinsic activity 41.0 % 10.1016/j.bmc.2016.05.043
Homo sapiens Alpha-2a adrenergic receptor Intrinsic activity 53.0 % 10.1016/j.bmc.2010.11.020
Homo sapiens Alpha-2a adrenergic receptor Ki 3.8 nM 10.1021/jm960012o
Homo sapiens Alpha-2a adrenergic receptor Ki 3.8 nM 10.1021/jm960359r
Homo sapiens Alpha-2a adrenergic receptor Ki 7.943 nM 10.1016/0960-894X(94)85032-1
Homo sapiens Alpha-2a adrenergic receptor Ki 8.71 nM 10.1016/j.bmc.2012.06.008
Homo sapiens Alpha-2a adrenergic receptor Ki 28.0 nM 10.1016/j.bmc.2016.05.043
Homo sapiens Alpha-2a adrenergic receptor Ki 105.0 nM None
Homo sapiens Alpha-2a adrenergic receptor Ki 853.0 nM 10.1021/jm990569e
Homo sapiens Alpha-2b adrenergic receptor AC50 141.3 nM 10.1038/s41467-023-40064-9
Homo sapiens Alpha-2b adrenergic receptor EC50 165.96 nM 10.1016/0960-894X(94)85032-1
Homo sapiens Alpha-2b adrenergic receptor EC50 1174.9 nM 10.1021/jm100977d
Homo sapiens Alpha-2b adrenergic receptor IC50 83.0 nM None
Homo sapiens Alpha-2b adrenergic receptor Intrinsic activity 0.45 None 10.1021/jm100977d
Homo sapiens Alpha-2b adrenergic receptor Ki 6.166 nM 10.1016/0960-894X(94)85032-1
Homo sapiens Alpha-2b adrenergic receptor Ki 31.62 nM 10.1016/j.bmc.2012.06.008
Homo sapiens Alpha-2b adrenergic receptor Ki 38.0 nM None
Homo sapiens Alpha-2c adrenergic receptor AC50 243.7 nM 10.1038/s41467-023-40064-9
Homo sapiens Alpha-2c adrenergic receptor EC50 54.95 nM 10.1016/0960-894X(94)85032-1
Homo sapiens Alpha-2c adrenergic receptor EC50 56.0 nM None
Homo sapiens Alpha-2c adrenergic receptor EC50 57.54 nM 10.1021/jm100977d
Homo sapiens Alpha-2c adrenergic receptor Emax 84.0 % None
Homo sapiens Alpha-2c adrenergic receptor IC50 nan None None
Homo sapiens Alpha-2c adrenergic receptor Intrinsic activity 0.6 None 10.1021/jm100977d
Homo sapiens Alpha-2c adrenergic receptor Ki 9.333 nM 10.1016/j.bmc.2012.06.008
Homo sapiens Alpha-2c adrenergic receptor Ki 30.0 nM 10.1021/jm960012o
Homo sapiens Alpha-2c adrenergic receptor Ki 30.0 nM 10.1021/jm960359r
Homo sapiens Alpha-2c adrenergic receptor Ki 56.23 nM 10.1016/0960-894X(94)85032-1
Homo sapiens Alpha-2c adrenergic receptor Ki 160.0 nM 10.1021/jm990569e
Homo sapiens Alpha-2c adrenergic receptor Ki nan None None
Homo sapiens Anandamide amidohydrolase Inhibition 20.5 % 10.1016/j.bmcl.2009.09.086
Homo sapiens Angiotensin II type 2 (AT-2) receptor AC50 100000.0 nM 10.1038/s41467-023-40064-9
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 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Beta-1 adrenergic receptor IC50 nan None None
Homo sapiens Beta-1 adrenergic receptor Ki nan None None
Homo sapiens Beta-2 adrenergic receptor AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Beta-2 adrenergic receptor AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Beta-2 adrenergic receptor IC50 nan None None
Homo sapiens Beta-2 adrenergic receptor Ki nan None None
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 Beta-secretase 1 Kd nan None 10.1016/j.ejmech.2017.06.020
Homo sapiens Bile salt export pump AC50 300000.0 nM 10.1038/s41467-023-40064-9
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 -4.66 None 10.1016/j.bmc.2011.03.011
Homo sapiens Caco-2 logPapp -4.59 None 10.1016/j.bmc.2009.08.022
Homo sapiens Calcitonin receptor IC50 nan None None
Homo sapiens Calcitonin receptor Ki nan None None
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 Cerebroside-sulfatase Potency 42.6 nM 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 AC50 nan None None
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 AC50 5011.87 nM None
Homo sapiens Cytochrome P450 2C19 AC50 nan None None
Homo sapiens Cytochrome P450 2C19 IC50 nan None None
Homo sapiens Cytochrome P450 2C19 Ki nan None None
Homo sapiens Cytochrome P450 2C19 Potency 5011.9 nM None
Homo sapiens Cytochrome P450 2C9 AC50 7943.28 nM None
Homo sapiens Cytochrome P450 2C9 AC50 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 nan None None
Homo sapiens Cytochrome P450 2C9 Ki nan None None
Homo sapiens Cytochrome P450 2C9 Potency 7943.3 nM None
Homo sapiens Cytochrome P450 2D6 AC50 7943.28 nM None
Homo sapiens Cytochrome P450 2D6 AC50 10000.0 nM None
Homo sapiens Cytochrome P450 2D6 AC50 39810.72 nM None
Homo sapiens Cytochrome P450 2D6 FC 1.0 None 10.1016/j.bmcl.2016.06.088
Homo sapiens Cytochrome P450 2D6 IC50 nan None None
Homo sapiens Cytochrome P450 2D6 Ki nan None None
Homo sapiens Cytochrome P450 2D6 Potency 7943.3 nM None
Homo sapiens Cytochrome P450 2D6 Potency 10000.0 nM None
Homo sapiens Cytochrome P450 2D6 Potency 39810.7 nM None
Homo sapiens Cytochrome P450 2E1 IC50 nan None None
Homo sapiens Cytochrome P450 2E1 Ki nan None None
Homo sapiens Cytochrome P450 3A4 AC50 nan None None
Homo sapiens Cytochrome P450 3A4 FC 1.0 None 10.1016/j.bmcl.2016.06.088
Homo sapiens Cytochrome P450 3A4 IC50 nan None None
Homo sapiens Cytochrome P450 3A4 Ki nan None None
Homo sapiens Delta opioid receptor AC50 30000.0 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 10000.0 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 30000.0 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 HEK293 CC50 nan None 10.1016/j.ejmech.2017.06.020
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 390.0 nM 10.1038/s41467-023-40064-9
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 -13.58 % 10.6019/CHEMBL4808148
Homo sapiens Histone deacetylase 6 Inhibition -4.87 % 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 Activity 0.95 % 10.1016/j.ejmech.2009.11.034
Homo sapiens Homo sapiens CL 4.0 mL.min-1.kg-1 10.1021/jm900403j
Homo sapiens Homo sapiens CL 177.0 mL/min None
Homo sapiens Homo sapiens CL-renal 102.0 mL/min None
Homo sapiens Homo sapiens CL_renal 2.48 mL.min-1.kg-1 10.1021/jm900403j
Homo sapiens Homo sapiens C ss 0.4 ng/mL None
Homo sapiens Homo sapiens C ss 0.8 ng/mL None
Homo sapiens Homo sapiens C ss 1.1 ng/mL None
Homo sapiens Homo sapiens DILI_Concern nan None 10.1016/j.drudis.2016.02.015
Homo sapiens Homo sapiens DILI_severity_class 3.0 None 10.1016/j.drudis.2016.02.015
Homo sapiens Homo sapiens F 60.0 % 10.1016/j.bmc.2007.08.060
Homo sapiens Homo sapiens F 60.0 % None
Homo sapiens Homo sapiens Recovery 40.0 % None
Homo sapiens Homo sapiens T1/2 0.3333 hr None
Homo sapiens Homo sapiens T1/2 12.0 hr None
Homo sapiens Homo sapiens T1/2 24.0 hr None
Homo sapiens Homo sapiens T1/2 41.0 hr None
Homo sapiens Homo sapiens Vd app 197.0 L None
Homo sapiens Homo sapiens Vdss 2.1 L.kg-1 10.1016/j.ejmech.2009.06.004
Homo sapiens Hydroxycarboxylic acid receptor 2 AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Hypoxia-inducible factor 1 alpha Potency 12589.3 nM None
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 1090.3 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 Menin/Histone-lysine N-methyltransferase MLL Potency 35481.3 nM None
Homo sapiens Monoamine oxidase Ki 100.0 nM 10.1021/jm00019a001
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 and toxin extrusion protein 1 IC50 33300.0 nM 10.1021/jm301302s
Homo sapiens Multidrug and toxin extrusion protein 1 Inhibition 1.0 % 10.1021/jm301302s
Homo sapiens Mu opioid receptor AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Mu opioid receptor Activity 0.59 None 10.1073/pnas.0706980105
Homo sapiens Mu opioid receptor Activity nan None 10.1074/jbc.m703272200
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 10000.0 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 Nischarin Ki 8.9 nM 10.1021/jm960012o
Homo sapiens Nischarin Ki 10.0 nM 10.1021/jm00019a001
Homo sapiens Nischarin Ki 54.95 nM 10.1016/j.bmc.2008.06.051
Homo sapiens Nischarin Ki 55.0 nM 10.1016/j.bmc.2008.06.051
Homo sapiens Norepinephrine transporter AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Norepinephrine transporter IC50 20000.0 nM 10.1021/jm9506433
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/s0378-5173(03)00372-7
Homo sapiens Phosphodiesterase 3A AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Phosphodiesterase 4D AC50 30000.0 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 Platelet activating factor receptor IC50 nan None None
Homo sapiens Platelet activating factor receptor Ki nan None None
Homo sapiens Prelamin-A/C Potency 281.8 nM None
Homo sapiens Prelamin-A/C Potency 35481.3 nM 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 Regulator of G-protein signaling 4 Potency 21192.3 nM 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 1a (5-HT1a) receptor Ki 3235.94 nM 10.1021/ml300064v
Homo sapiens Serotonin 1b (5-HT1b) receptor Inhibition 5.0 % 10.1016/j.bmcl.2004.06.085
Homo sapiens Serotonin 1d (5-HT1d) receptor Inhibition 5.0 % 10.1016/j.bmcl.2004.06.085
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 30000.0 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 K' 0.13 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 -6.71 None 10.1016/j.bmc.2007.07.050
Homo sapiens SK-N-MC Activity nan None 10.1038/nchembio.79
Homo sapiens SK-N-SH Activity nan None 10.1038/nchembio.79
Homo sapiens Solute carrier family 22 member 1 Activity 0.71 uM 10.1124/mol.63.3.489
Homo sapiens Solute carrier family 22 member 1 Activity nan None 10.1124/mol.51.6.913
Homo sapiens Solute carrier family 22 member 1 IC50 18980.0 nM 10.1021/acs.jmedchem.6b01317
Homo sapiens Solute carrier family 22 member 1 IC50 22600.0 nM 10.1021/jm8003152
Homo sapiens Solute carrier family 22 member 1 Inhibition 65.4 % 10.1021/jm8003152
Homo sapiens Solute carrier family 22 member 1 Ki 550.0 nM None
Homo sapiens Solute carrier family 22 member 1 Ratio 1.26 None 10.1021/acs.jmedchem.6b01317
Homo sapiens Solute carrier family 22 member 3 IC50 79300.0 nM 10.1007/s002100000335
Homo sapiens Solute carrier family 22 member 3 Ki 373000.0 nM 10.1152/ajprenal.2000.279.3.f449
Homo sapiens Solute carrier family 22 member 4 Activity 70.9 % None
Homo sapiens Solute carrier family 22 member 5 Activity 67.6 % None
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
Homo sapiens Whole blood Retention_time 2.44 min 10.1007/s00044-012-9977-1
Leishmania amazonensis Leishmania amazonensis IC50 nan None 10.1016/j.bmc.2010.01.068
Leishmania donovani Leishmania donovani IC50 nan None 10.1016/j.bmc.2010.01.068
Leishmania infantum Leishmania infantum IC50 nan None 10.1016/j.bmc.2010.01.068
Leishmania major Leishmania major IC50 nan None 10.1016/j.bmc.2010.01.068
Leishmania mexicana Leishmania mexicana IC50 nan None 10.1016/j.bmc.2010.01.068
Mus musculus Alpha-2 adrenergic receptor IC40 3.68 nM 10.1021/jm00371a003
Mus musculus Alpha-2 adrenergic receptor pD2 8.8 None 10.1021/jm00371a003
Mus musculus Mus musculus Activity 8.94 mA 10.1016/j.bmc.2017.08.012
Mus musculus Mus musculus Activity 18.0 bpm 10.1016/j.bmcl.2020.127595
Mus musculus Mus musculus Activity 18.0 mmHg 10.1016/j.bmcl.2020.127595
Mus musculus Mus musculus Activity 28.0 mmHg 10.1016/j.bmcl.2020.127595
Mus musculus Mus musculus Activity nan None 10.1021/jm100977d
Mus musculus Mus musculus Activity nan None None
Mus musculus Mus musculus Antagonism 0.0 None 10.1021/jm9506433
Mus musculus Mus musculus ED50 0.02 mg.kg-1 10.1021/jm00117a023
Mus musculus Mus musculus ED50 0.36 mg.kg-1 10.1021/jm9506433
Mus musculus Mus musculus Inhibition 0.05 % 10.1021/jm000128r
Mus musculus Mus musculus Inhibition 0.05 % 10.1021/jm990569e
Mus musculus Mus musculus Inhibition nan % 10.1016/j.bmcl.2020.127595
Mus musculus Mus musculus pD2 8.8 None 10.1021/jm00159a037
Mus musculus Mus musculus Permeability nan None 10.1021/jm990968+
Mus musculus Nitric oxide synthase, inducible IC50 nan None None
Mus musculus Nitric oxide synthase, inducible Ki nan None None
Mus musculus Solute carrier family 22 member 3 Inhibition 90.0 % 10.1152/ajprenal.2000.279.3.f449
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
Oryctolagus cuniculus Oryctolagus cuniculus ED30 0.065 mg kg-1 10.1016/j.ejmech.2018.03.076
Oryctolagus cuniculus Oryctolagus cuniculus pC25 2.04 uM kg-1 10.1021/jm00370a011
Oryctolagus cuniculus Oryctolagus cuniculus pC60 1.78 uM kg-1 10.1021/jm00370a011
Plasmodium falciparum Plasmodium falciparum IC50 nan None 10.1016/j.bmc.2010.01.068
Plasmodium falciparum Plasmodium falciparum Potency 11995.5 nM None
Pneumocystis carinii Pneumocystis carinii IC50 nan None 10.1016/j.bmc.2010.01.068
Rattus norvegicus Acetylcholinesterase IC50 nan nM 10.1021/jm9506433
Rattus norvegicus Adenosine A2b receptor pD2 8.8 None 10.1021/jm00360a008
Rattus norvegicus Adrenergic receptor alpha pC25 2.04 None 10.1021/jm00137a006
Rattus norvegicus Adrenergic receptor alpha pC60 1.78 None 10.1021/jm00137a006
Rattus norvegicus Adrenergic receptor alpha Ratio 17.0 None 10.1021/jm00148a005
Rattus norvegicus Adrenergic receptor alpha-1 IC50 1200.0 nM 10.1021/jm00370a011
Rattus norvegicus Adrenergic receptor alpha-1 Inhibition nan % 10.1016/j.bmcl.2016.09.037
Rattus norvegicus Adrenergic receptor alpha-1 Ki 116.0 nM 10.1021/jm000128r
Rattus norvegicus Adrenergic receptor alpha-1 Ki 116.0 nM 10.1021/jm990569e
Rattus norvegicus Adrenergic receptor alpha-1 Ki 310.0 nM 10.1021/jm00158a013
Rattus norvegicus Adrenergic receptor alpha-1 Ki 520.0 nM 10.1021/jm00148a005
Rattus norvegicus Adrenergic receptor alpha-1 Ki 520.0 nM 10.1021/jm00389a009
Rattus norvegicus Adrenergic receptor alpha-1 Ki 527.6 nM 10.1021/jm00343a015
Rattus norvegicus Adrenergic receptor alpha-1 Potency 0.8 None 10.1021/jm00127a037
Rattus norvegicus Adrenergic receptor alpha-1 Potency nan None 10.1021/jm00127a037
Rattus norvegicus Adrenergic receptor alpha-2 IC50 3.1 nM 10.1021/jm00370a011
Rattus norvegicus Adrenergic receptor alpha-2 IC50 3.9 nM 10.1021/jm00392a005
Rattus norvegicus Adrenergic receptor alpha-2 IC50 17.3 nM 10.1021/jm00157a011
Rattus norvegicus Adrenergic receptor alpha-2 Ki 1.5 nM 10.1021/jm00158a013
Rattus norvegicus Adrenergic receptor alpha-2 Ki 1.7 nM 10.1021/jm00343a015
Rattus norvegicus Adrenergic receptor alpha-2 Ki 1.8 nM 10.1021/jm00392a005
Rattus norvegicus Adrenergic receptor alpha-2 Ki 2.512 nM 10.1016/j.bmc.2015.03.009
Rattus norvegicus Adrenergic receptor alpha-2 Ki 2.7 nM 10.1016/j.bmcl.2016.09.037
Rattus norvegicus Adrenergic receptor alpha-2 Ki 5.7 nM 10.1021/jm00354a001
Rattus norvegicus Adrenergic receptor alpha-2 Ki 8.7 nM 10.1016/j.bmc.2010.11.039
Rattus norvegicus Adrenergic receptor alpha-2 Ki 8.7 nM 10.1016/j.bmcl.2008.11.055
Rattus norvegicus Adrenergic receptor alpha-2 Ki 30.0 nM 10.1021/jm00148a005
Rattus norvegicus Adrenergic receptor alpha-2 Ki 30.0 nM 10.1021/jm00389a009
Rattus norvegicus Adrenergic receptor alpha-2 Potency 0.49 None 10.1021/jm00127a037
Rattus norvegicus Adrenergic receptor alpha-2 Potency nan None 10.1021/jm00127a037
Rattus norvegicus Aldose reductase IC50 nan None None
Rattus norvegicus Aldose reductase Ki nan None None
Rattus norvegicus Alpha-1a adrenergic receptor IC50 372.0 nM None
Rattus norvegicus Alpha-1a adrenergic receptor Intrinsic activity 0.83 None 10.1021/jm00115a008
Rattus norvegicus Alpha-1a adrenergic receptor Kd 257.04 nM 10.1021/jm00115a008
Rattus norvegicus Alpha-1a adrenergic receptor Ki 151.0 nM None
Rattus norvegicus Alpha-1a adrenergic receptor pD2 7.84 None 10.1021/jm00115a008
Rattus norvegicus Alpha-1b adrenergic receptor IC50 1848.0 nM None
Rattus norvegicus Alpha-1b adrenergic receptor Ki 1023.0 nM None
Rattus norvegicus Alpha-2a adrenergic receptor Ki 0.39 nM 10.1021/jm000128r
Rattus norvegicus Alpha-2a adrenergic receptor Ki 0.39 nM 10.1021/jm990569e
Rattus norvegicus Alpha-2a adrenergic receptor Ki 853.0 nM 10.1021/jm000128r
Rattus norvegicus Alpha-2b adrenergic receptor Ki 8.3 nM 10.1021/jm960012o
Rattus norvegicus Alpha-2b adrenergic receptor Ki 8.3 nM 10.1021/jm960359r
Rattus norvegicus Alpha-2b adrenergic receptor Ki 160.0 nM 10.1021/jm000128r
Rattus norvegicus Amine oxidase, copper containing Ki 900000.0 nM 10.1016/s0960-894x(01)00506-6
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 Inhibition nan % 10.1016/j.bmcl.2016.09.037
Rattus norvegicus Brain Fu 0.42 None 10.1124/dmd.110.035998
Rattus norvegicus Brain Kp 2.47 None 10.1124/dmd.110.035998
Rattus norvegicus Brain Vd 5.9 L.kg-1 10.1124/dmd.110.035998
Rattus norvegicus Cyclooxygenase-1 AC50 30000.0 nM 10.1038/s41467-023-40064-9
Rattus norvegicus Dopamine receptor Ki 4000.0 nM 10.1021/jm00158a013
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 Inositol monophosphatase 1 Potency 31622.8 nM None
Rattus norvegicus Insulin receptor IC50 nan None None
Rattus norvegicus Insulin receptor Ki nan None None
Rattus norvegicus Muscarinic acetylcholine receptor IC50 nan nM 10.1021/jm9506433
Rattus norvegicus Muscarinic acetylcholine receptor M1 Potency 19952.6 nM None
Rattus norvegicus Muscarinic acetylcholine receptor M1 Potency 25118.9 nM None
Rattus norvegicus Nischarin IC50 366.2 nM 10.1016/j.bmc.2010.11.039
Rattus norvegicus Nischarin IC50 366.2 nM 10.1016/j.bmcl.2008.11.055
Rattus norvegicus Nischarin Ki 14.1 nM 10.1021/jm501456p
Rattus norvegicus Nischarin Ki 112.2 nM 10.1007/s00044-004-0023-9
Rattus norvegicus Nischarin Ki 125.89 nM 10.1016/j.bmc.2016.05.043
Rattus norvegicus Nischarin Ki 281.84 nM 10.1016/j.bmc.2012.06.008
Rattus norvegicus Nitric-oxide synthase, brain IC50 nan None None
Rattus norvegicus Nitric-oxide synthase, brain Ki nan None None
Rattus norvegicus PC-12 Activity nan None 10.1038/nchembio.79
Rattus norvegicus Plasma logFu 0.8 None 10.1016/j.ejmech.2009.06.004
Rattus norvegicus Rattus norvegicus Activity 15.0 % 10.1021/jm00230a014
Rattus norvegicus Rattus norvegicus Activity 43.0 % 10.1021/jm00221a034
Rattus norvegicus Rattus norvegicus Activity rating 0.0 None 10.1021/jm00136a006
Rattus norvegicus Rattus norvegicus Activity rating 1.0 None 10.1021/jm00136a006
Rattus norvegicus Rattus norvegicus Activity rating 2.0 None 10.1021/jm00136a006
Rattus norvegicus Rattus norvegicus ALB 39000.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALB 39300.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALB 40700.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALB 42300.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALB 42700.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALP 207.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALP 306.67 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALP 319.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALP 335.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALP 360.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALP 371.5 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALT 33.67 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALT 45.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALT 48.67 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALT 49.67 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALT 56.17 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALT 61.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus AST 74.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus AST 86.5 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus AST 91.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus AST 93.67 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus AST 94.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus AST 172.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BASO 0.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BASOLE 0.0 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BILI 1.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BILI 1.7 ug.mL-1 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 2.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus Blood pressure -21.0 mmHg 10.1021/jm001017v
Rattus norvegicus Rattus norvegicus Blood pressure -15.0 mmHg 10.1021/jm00072a016
Rattus norvegicus Rattus norvegicus Blood pressure -15.0 mmHg 10.1021/jm001017v
Rattus norvegicus Rattus norvegicus Blood pressure -9.0 mmHg 10.1021/jm00072a016
Rattus norvegicus Rattus norvegicus BP -29.0 mmHg 10.1021/jm00117a023
Rattus norvegicus Rattus norvegicus BP -19.0 mmHg 10.1021/jm00117a023
Rattus norvegicus Rattus norvegicus BP -18.0 mmHg 10.1021/jm991004l
Rattus norvegicus Rattus norvegicus BP -16.0 mmHg 10.1021/jm991004l
Rattus norvegicus Rattus norvegicus BUN 143.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BUN 153.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BUN 183.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BUN 190.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BUN 206.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BUN 580.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus Change -21.0 % 10.1016/s0960-894x(99)00569-7
Rattus norvegicus Rattus norvegicus Change -17.0 % 10.1016/s0960-894x(99)00569-7
Rattus norvegicus Rattus norvegicus Change -16.0 % 10.1016/s0960-894x(99)00569-7
Rattus norvegicus Rattus norvegicus Change -15.0 % 10.1016/s0960-894x(99)00569-7
Rattus norvegicus Rattus norvegicus CHLORIDE 96.0 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHLORIDE 99.5 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHLORIDE 99.83 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHLORIDE 100.67 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHLORIDE 101.67 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHLORIDE 104.0 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHOL 626.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHOL 665.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHOL 673.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHOL 700.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHOL 718.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHOL 750.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CK 177.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CK 321.67 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CK 371.67 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CK 506.83 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CK 518.5 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CK 987.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CO2 23330000.0 nM 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CO2 27000000.0 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 29170000.0 nM 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CO2 30670000.0 nM 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus Control 30.0 % 10.1021/jm00027a015
Rattus norvegicus Rattus norvegicus Control 50.0 % 10.1021/jm00027a015
Rattus norvegicus Rattus norvegicus Control 86.0 % 10.1021/jm00027a015
Rattus norvegicus Rattus norvegicus Control 112.0 % 10.1021/jm00027a015
Rattus norvegicus Rattus norvegicus Control 115.0 % 10.1021/jm00027a015
Rattus norvegicus Rattus norvegicus Control 130.0 % 10.1021/jm00027a015
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 1.9 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CREAT 2.5 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CREAT 5.2 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus Decrease 20.0 % 10.1021/jm00136a006
Rattus norvegicus Rattus norvegicus Decrease 21.0 % 10.1021/jm00136a006
Rattus norvegicus Rattus norvegicus Decrease 25.0 % 10.1021/jm00136a006
Rattus norvegicus Rattus norvegicus Decrease in blood pressure 12.0 % 10.1021/jm00354a023
Rattus norvegicus Rattus norvegicus Decrease in blood pressure 13.5 % 10.1021/jm00354a023
Rattus norvegicus Rattus norvegicus Decrease in SBP 15.0 % 10.1021/jm00097a009
Rattus norvegicus Rattus norvegicus Delta blood pressure 9.0 None 10.1021/jm00144a017
Rattus norvegicus Rattus norvegicus Delta blood pressure 16.0 None 10.1021/jm00144a017
Rattus norvegicus Rattus norvegicus Delta blood pressure 21.0 None 10.1021/jm00144a017
Rattus norvegicus Rattus norvegicus Delta blood pressure 32.0 None 10.1021/jm00144a017
Rattus norvegicus Rattus norvegicus Delta blood pressure 36.0 None 10.1021/jm00144a017
Rattus norvegicus Rattus norvegicus Delta blood pressure 38.0 mmHg 10.1021/jm00364a027
Rattus norvegicus Rattus norvegicus Delta blood pressure 45.0 None 10.1021/jm00144a017
Rattus norvegicus Rattus norvegicus Diuretic activity 0.16 m equiv 10.1021/jm00378a030
Rattus norvegicus Rattus norvegicus DOSE 0.06 mg.kg-1 10.1021/jm00186a019
Rattus norvegicus Rattus norvegicus DOSE 0.11 mg.kg-1 10.1021/jm00186a019
Rattus norvegicus Rattus norvegicus DOSE 0.18 mg.kg-1 10.1021/jm00186a019
Rattus norvegicus Rattus norvegicus dp/dt -871.0 mmHg s-1 10.1021/jm00072a016
Rattus norvegicus Rattus norvegicus dP/dt -1345.0 mmHg s-1 10.1021/jm991004l
Rattus norvegicus Rattus norvegicus ED50 0.1 mg.kg-1 10.1021/jm000128r
Rattus norvegicus Rattus norvegicus ED50 0.1 mg.kg-1 10.1021/jm990569e
Rattus norvegicus Rattus norvegicus Effect 20.0 % 10.1021/jm00186a019
Rattus norvegicus Rattus norvegicus EOS 0.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOS 24.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOS 25.33 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOS 46.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOSLE 0.0 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOSLE 0.17 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOSLE 0.33 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus GLUC 1343.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus GLUC 1403.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus GLUC 1433.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus GLUC 1543.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus GLUC 1621.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus GLUC 1630.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HCT 34.07 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HCT 35.27 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HCT 35.55 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HCT 35.6 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HCT 38.83 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HCT 40.63 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus Heart rate -53.0 beats min-1 10.1021/jm991004l
Rattus norvegicus Rattus norvegicus Heart rate -40.0 beats min-1 10.1021/jm00072a016
Rattus norvegicus Rattus norvegicus HGB 136000.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HGB 137200.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HGB 137300.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HGB 141200.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HGB 152300.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HGB 161700.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HR 180.0 beats min-1 10.1021/jm00123a013
Rattus norvegicus Rattus norvegicus HR 180.0 beats min-1 10.1021/jm00378a030
Rattus norvegicus Rattus norvegicus HR 220.0 beats min-1 10.1021/jm00378a030
Rattus norvegicus Rattus norvegicus ID50 0.3 mg.kg-1 10.1021/jm00164a024
Rattus norvegicus Rattus norvegicus IE1 8.01 eV 10.1021/jm00182a015
Rattus norvegicus Rattus norvegicus LDH 128.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LDH 166.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LDH 238.83 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LDH 264.5 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LDH 289.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LDH 310.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LIPASE 8.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LIPASE 9.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LIPASE 9.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LIPASE 9.67 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus Log 1/ED30 1.99 uM kg-1 10.1021/jm00182a015
Rattus norvegicus Rattus norvegicus LYM 9488.67 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYM 11339.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYM 12125.33 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYM 13105.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYM 15419.33 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYM 15680.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYMLE 61.33 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYMLE 81.33 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYMLE 85.5 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYMLE 87.0 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYMLE 87.33 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYMLE 89.33 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MABP 102.0 mmHg 10.1021/jm00123a013
Rattus norvegicus Rattus norvegicus MABP 102.0 mmHg 10.1021/jm00378a030
Rattus norvegicus Rattus norvegicus MABP 113.0 mmHg 10.1021/jm00378a030
Rattus norvegicus Rattus norvegicus MCH 23.2 pg 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCH 23.23 pg 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCH 23.62 pg 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCH 23.65 pg 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCH 24.47 pg 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCH 25.13 pg 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCHC 385500.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCHC 385700.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCHC 392300.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCHC 397700.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCHC 398000.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCHC 403000.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCV 59.1 fL 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCV 59.52 fL 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCV 60.37 fL 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCV 61.23 fL 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCV 61.5 fL 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCV 62.3 fL 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONO 52.33 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONO 76.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONO 92.33 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONO 118.67 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONO 122.67 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONO 767.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONOLE 0.33 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONOLE 0.5 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONOLE 0.67 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONOLE 1.0 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONOLE 4.0 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTLE 10.33 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTLE 12.0 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTLE 12.33 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTLE 13.83 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTLE 17.33 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTLE 34.67 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTSG 1322.33 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTSG 2102.33 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTSG 2145.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTSG 2180.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTSG 2191.33 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTSG 6827.33 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus pC20 7.96 None 10.1021/jm00352a003
Rattus norvegicus Rattus norvegicus pD2 7.66 None 10.1021/jm00230a014
Rattus norvegicus Rattus norvegicus PHOS 81.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PHOS 104.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PHOS 106.8 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PHOS 111.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PHOS 119.2 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PHOS 129.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PLAT 916000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PLAT 1189830.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PLAT 1266670.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PLAT 1290670.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PLAT 1325670.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PLAT 1516670.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus POTASSIUM 5.61 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus POTASSIUM 6.28 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus POTASSIUM 6.5 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus POTASSIUM 6.55 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus POTASSIUM 6.56 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PROT 55700.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PROT 56300.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PROT 58700.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PROT 59000.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PROT 60000.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PROT 61300.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus RBC 5470000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus RBC 5810000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus RBC 5840000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus RBC 6000000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus RBC 6570000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus RBC 6600000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus RBCNUC 0.0 /100WBC 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus RBCNUC 0.17 /100WBC 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus SODIUM 140.53 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus SODIUM 140.77 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus SODIUM 141.53 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus SODIUM 141.88 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus SODIUM 141.9 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus SODIUM 148.9 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus Tissue Severity Score nan None 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus URATE 7.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus URATE 15.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus URATE 16.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus URATE 16.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus URATE 18.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus URATE 21.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus WBC 11830.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus WBC 13500.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus WBC 15350.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus WBC 17730.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus WBC 17900.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus WBC 18930.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Serotonin 1a (5-HT1a) receptor IC50 5365.0 nM None
Rattus norvegicus Serotonin 1a (5-HT1a) receptor Ki 3066.0 nM 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 Solute carrier family 22 member 1 Ki 1400.0 nM 10.1007/bf00171063
Rattus norvegicus Solute carrier family 22 member 5 Inhibition nan % None
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 Replicase polyprotein 1ab Inhibition 17.54 % 10.6019/CHEMBL4495564
Severe acute respiratory syndrome coronavirus 2 SARS-CoV-2 Hit score 0.1651 None 10.1101/2020.04.21.054387
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
Severe acute respiratory syndrome coronavirus 2 SARS-CoV-2 Inhibition -0.02 % 10.6019/CHEMBL4495565
Toxoplasma gondii Toxoplasma gondii IC50 nan None 10.1016/j.bmc.2010.01.068
Trichomonas vaginalis Trichomonas vaginalis IC50 nan None 10.1016/j.bmc.2010.01.068
Trypanosoma brucei Trypanosoma brucei IC50 nan None 10.1016/j.bmc.2010.01.068
Trypanosoma brucei brucei Trypanosoma brucei brucei IC50 nan None 10.1016/j.bmc.2010.01.068
Trypanosoma brucei rhodesiense Trypanosoma brucei rhodesiense IC50 nan None 10.1016/j.bmc.2010.01.068
Trypanosoma cruzi Cruzipain Potency 39810.7 nM None
Trypanosoma cruzi Trypanosoma cruzi IC50 nan None 10.1016/j.bmc.2010.01.068
None ADMET Binding energy 12.3 kCal mol-1 10.1021/jm00378a021
None ADMET Biotransformation nan None 10.1038/s41586-019-1291-3
None ADMET CL 4.0 mL.min-1.kg-1 10.1124/dmd.108.020479
None ADMET delta logD -0.82 None 10.1021/jm0000564
None ADMET delta logP 2.44 None 10.1021/jm00398a028
None ADMET Diuretic activity 1.5 m equiv 10.1021/jm00378a030
None ADMET Diuretic activity 16.4 ml 10.1021/jm00378a030
None ADMET eLog D 0.29 None 10.1021/jm0200409
None ADMET F 80.0 % 10.1021/jm0000564
None ADMET Fraction ionised 0.817 None 10.1021/jm0200409
None ADMET Fu 0.158 None 10.1021/jm0200409
None ADMET Fu 0.8 None 10.1021/jm0200409
None ADMET Fu 0.8 None 10.1021/jm030408h
None ADMET LogP app -4.98 None 10.1016/j.bmc.2007.03.040
None ADMET LogP app -4.94 None 10.1016/j.bmc.2007.03.040
None ADMET MRT 14.0 hr 10.1124/dmd.108.020479
None ADMET Papp 11.44 10^-6 cm/s 10.1016/j.bmc.2007.03.040
None ADMET Peff 3.8 ucm/s 10.1016/j.bmc.2014.08.035
None ADMET Peff 4.56 10'-6 cm/s 10.1039/C6MD00053C
None ADMET Peff 4.7 10'-6 cm/s 10.1016/j.ejmech.2016.07.052
None ADMET Peff 4.7 ucm/s 10.1016/j.bmcl.2016.03.086
None ADMET Peff 5.1 10'-6 cm/s 10.1016/j.bmc.2015.01.005
None ADMET Peff 5.1 10'-6 cm/s 10.1016/j.ejmech.2014.09.081
None ADMET Peff 5.3 10'-6 cm/s 10.1016/j.bmc.2015.01.005
None ADMET Peff 5.3 10'-6 cm/s 10.1016/j.bmc.2016.08.036
None ADMET Peff 5.3 10'-6 cm/s 10.1016/j.ejmech.2016.07.052
None ADMET Peff 5.3 10'-6 cm/s 10.1039/C6MD00053C
None ADMET Peff 5.3 10^-6 cm/s 10.1016/j.bmc.2016.09.061
None ADMET Peff 5.3 10^-6 cm/s 10.1016/j.bmc.2020.115940
None ADMET Peff 5.3 10^-6 cm/s 10.1016/j.ejmech.2020.112751
None ADMET Peff 5.3 ucm/s 10.1016/j.ejmech.2015.10.007
None ADMET Peff 6.3 10^-6 cm/s 10.1016/j.bmc.2016.09.061
None ADMET Peff 6.5 10'-6 cm/s 10.1016/j.bmc.2014.07.053
None ADMET Peff 6.5 10'-6 cm/s 10.1016/j.bmc.2016.08.036
None ADMET Peff 6.5 10'-6 cm/s 10.1016/j.bmcl.2014.10.025
None ADMET Peff 6.5 ucm/s 10.1016/j.ejmech.2015.10.007
None ADMET permeability 4.0 10^-6 cm/s 10.1016/j.ejmech.2021.113554
None ADMET permeability 4.2 10'-6 cm/s 10.1021/jm801292b
None ADMET permeability 4.7 10'-6 cm/s 10.1016/j.bmc.2016.07.025
None ADMET permeability 5.1 10'-6 cm/s 10.1016/j.bmc.2016.11.048
None ADMET permeability 5.1 ucm/s 10.1016/j.bmc.2013.09.050
None ADMET permeability 5.1 ucm/s 10.1016/j.bmc.2016.04.012
None ADMET permeability 5.2 ucm/s 10.1016/j.bmc.2013.05.043
None ADMET permeability 5.26 10'-6 cm/s 10.1016/j.ejmech.2015.08.057
None ADMET permeability 5.3 10'-6 cm/s 10.1016/j.bmc.2016.11.048
None ADMET permeability 5.3 10'-6 cm/s 10.1016/j.ejmech.2015.03.040
None ADMET permeability 5.3 10'-6 cm/s 10.1021/jm900859q
None ADMET permeability 5.3 10^-6 cm/s 10.1016/j.ejmech.2021.113735
None ADMET permeability 5.3 10^-6 cm/s 10.1039/c9md00441f
None ADMET permeability 5.3 ucm/s 10.1016/j.bmc.2013.09.050
None ADMET permeability 5.3 ucm/s 10.1016/j.bmc.2016.02.023
None ADMET permeability 5.3 ucm/s 10.1016/j.bmc.2016.04.012
None ADMET permeability 5.3 ucm/s 10.1016/j.bmc.2016.09.050
None ADMET permeability 5.3 ucm/s 10.1016/j.ejmech.2013.12.008
None ADMET permeability 5.5 ucm/s 10.1016/j.bmc.2016.12.013
None ADMET permeability 5.7 10^-6 cm/s 10.1016/j.ejmech.2022.114210
None ADMET permeability 5.8 10'-6 cm/s 10.1016/j.ejmech.2015.01.058
None ADMET permeability 6.3 10'-6 cm/s 10.1016/j.ejmech.2011.08.002
None ADMET permeability 6.3 ucm/s 10.1016/j.bmcl.2012.01.090
None ADMET permeability 6.5 10'-6 cm/s 10.1016/j.ejmech.2014.07.021
None ADMET permeability 6.5 10^-6 cm/s 10.1016/j.ejmech.2022.114354
None ADMET permeability 6.84 ucm/s 10.1016/j.bmc.2016.09.050
None ADMET permeability 7.18 10'-6 cm/s 10.1016/j.ejmech.2015.03.040
None ADMET permeability 7.36 10^-6 cm/s 10.1016/j.ejmech.2021.113441
None ADMET permeability 8.14 ucm/s 10.1016/j.bmc.2016.02.023
None ADMET permeability 9.5 10'-6 cm/s 10.1021/jm900628z
None ADMET permeability 9.5 ucm/s 10.1016/j.ejmech.2011.03.003
None ADMET permeability 10.2 10'-6 cm/s 10.1021/jm900859q
None ADMET permeability 14.1 10'-6 cm/s 10.1021/jm900859q
None ADMET Ratio 0.8 None 10.1021/jm00186a019
None ADMET Ratio 1.83 None 10.1021/jm00186a019
None ADMET Ratio 3.0 None 10.1021/jm00186a019
None ADMET T1/2 7.6 hr 10.1124/dmd.108.020479
None ADMET Vdss 2.1 L.kg-1 10.1021/jm0200409
None ADMET Vdss 2.1 L.kg-1 10.1021/jm030408h
None ADMET Vdss 3.3 L.kg-1 10.1124/dmd.108.020479
None Hepatotoxicity Alkaline Phosphatase Increase - Activity Score nan None 10.2174/1570163043334794
None Hepatotoxicity Alkaline Phosphatase Increase - Index Value 11.5 None 10.2174/1570163043334794
None Hepatotoxicity Alkaline Phosphatase Increase - Number of Reports 4.0 None 10.2174/1570163043334794
None Hepatotoxicity Composite Activity - Active 2.0 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 9.5 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 1.0 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 0.0 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 nan None 10.2174/1570163043334794
None Hepatotoxicity LDH Increase - Number of Reports nan None 10.2174/1570163043334794
None Hepatotoxicity LTKB_BD DILI severity score 3.0 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 nan None 10.2174/1570163043334794
None Hepatotoxicity SGOT Increase - Number of Reports nan None 10.2174/1570163043334794
None Hepatotoxicity SGPT Increase - Activity Score nan None 10.2174/1570163043334794
None Hepatotoxicity SGPT Increase - Index Value 7.6 None 10.2174/1570163043334794
None Hepatotoxicity SGPT Increase - Number of Reports 4.0 None 10.2174/1570163043334794
None NON-PROTEIN TARGET Activity nan None None
None NON-PROTEIN TARGET Fu 0.56 None 10.1124/dmd.108.020479
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) 1.0 None 10.1016/s0399-8320(04)95062-2
None NON-PROTEIN TARGET Hepatotoxicity (moderate) 12.5 % 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 NON-PROTEIN TARGET IC50 nan None 10.1016/j.bmc.2010.01.068
None NON-PROTEIN TARGET Potency 1.3 nM None
None NON-PROTEIN TARGET Potency 188.2 nM None
None NON-PROTEIN TARGET Potency 13324.4 nM None
None No relevant target deltaRm 0.38 None 10.1021/jm00230a014
None No relevant target LogD 0.06 None 10.1021/jm0000564
None No relevant target LogD 0.62 None 10.1021/jm0100990
None No relevant target LogD 0.85 None 10.1021/jm00137a006
None No relevant target LogD 0.85 None 10.1021/jm00370a011
None No relevant target LogD 0.93 None 10.1021/jf102525e
None No relevant target LogP 0.83 None 10.1021/jm00230a014
None No relevant target LogP 0.91 None 10.1021/jm00352a003
None No relevant target LogP 1.08 None 10.1021/jm801441s
None No relevant target LogP 1.43 None 10.1016/j.bmc.2007.03.040
None No relevant target LogP 1.43 None 10.1021/jf102525e
None No relevant target LogP 1.57 None 10.1021/jm801441s
None No relevant target logPapp -4.98 None 10.1021/jf102525e
None No relevant target Log Pn -0.85 cyh 10.1021/jm00398a028
None No relevant target Log Pn 1.59 None 10.1021/jm00398a028
None No relevant target Peff 3.1 10'-6 cm/s 10.1016/j.ejmech.2017.07.077
None No relevant target Peff 3.71 10'-6 cm/s 10.1016/j.bmc.2018.04.037
None No relevant target Peff 4.8 ucm/s 10.1016/j.ejmech.2017.07.008
None No relevant target Peff 5.003 10'-6 cm/s 10.1016/j.bmc.2017.08.048
None No relevant target Peff 5.1 10'-6 cm/s 10.1016/j.bmc.2017.03.070
None No relevant target Peff 5.1 10'-6 cm/s 10.1016/j.bmc.2018.02.037
None No relevant target Peff 5.1 10'-6 cm/s 10.1016/j.bmcl.2017.09.055
None No relevant target Peff 5.1 10'-6 cm/s 10.1016/j.bmcl.2017.09.057
None No relevant target Peff 5.1 10'-6 cm/s 10.1016/j.bmcl.2018.04.043
None No relevant target Peff 5.1 10'-6 cm/s 10.1016/j.bmcl.2019.126625
None No relevant target Peff 5.1 10'-6 cm/s 10.1016/j.ejmech.2018.01.055
None No relevant target Peff 5.1 10'-6 cm/s 10.1016/j.ejmech.2018.12.013
None No relevant target Peff 5.1 ucm/s 10.1016/j.bmc.2018.11.015
None No relevant target Peff 5.3 10'-6 cm/s 10.1016/j.bmc.2017.05.027
None No relevant target Peff 5.3 10'-6 cm/s 10.1016/j.bmc.2017.08.048
None No relevant target Peff 5.3 10'-6 cm/s 10.1016/j.bmc.2018.01.030
None No relevant target Peff 5.3 10'-6 cm/s 10.1016/j.bmc.2018.02.037
None No relevant target Peff 5.3 10'-6 cm/s 10.1016/j.bmc.2018.04.037
None No relevant target Peff 5.3 10'-6 cm/s 10.1016/j.bmc.2018.04.043
None No relevant target Peff 5.3 10'-6 cm/s 10.1016/j.bmcl.2018.04.043
None No relevant target Peff 5.3 10'-6 cm/s 10.1016/j.bmcl.2019.126625
None No relevant target Peff 5.3 10'-6 cm/s 10.1016/j.ejmech.2017.02.039
None No relevant target Peff 5.3 10'-6 cm/s 10.1016/j.ejmech.2018.01.055
None No relevant target Peff 5.3 10'-6 cm/s 10.1016/j.ejmech.2018.11.040
None No relevant target Peff 5.3 10'-6 cm/s 10.1016/j.ejmech.2018.12.013
None No relevant target Peff 5.3 10'-6 cm/s 10.1016/j.ejmech.2019.06.026
None No relevant target Peff 5.3 ucm/s 10.1016/j.bmc.2017.02.027
None No relevant target Peff 5.3 ucm/s 10.1016/j.bmc.2018.11.015
None No relevant target Peff 5.3 ucm/s 10.1016/j.ejmech.2017.07.008
None No relevant target Peff 5.5 10'-6 cm/s 10.1016/j.bmc.2018.01.030
None No relevant target Peff 6.13 10'-6 cm/s 10.1016/j.ejmech.2018.11.040
None No relevant target Peff 8.8 10'-6 cm/s 10.1021/acs.jmedchem.0c01129
None No relevant target permeability 3.71 10'-6 cm/s 10.1016/j.ejmech.2017.08.025
None No relevant target permeability 4.19 10'-6 cm/s 10.1016/j.bmc.2017.05.027
None No relevant target permeability 5.0 10'-6 cm/s 10.1016/j.bmc.2018.04.043
None No relevant target permeability 5.1 10'-6 cm/s 10.1016/j.bmc.2019.01.040
None No relevant target permeability 5.1 10'-6 cm/s 10.1016/j.ejmech.2016.12.009
None No relevant target permeability 5.1 10'-6 cm/s 10.1016/j.ejmech.2017.02.039
None No relevant target permeability 5.1 10'-6 cm/s 10.1016/j.ejmech.2019.06.026
None No relevant target permeability 5.1 10'-6 cm/s 10.1016/j.ejmech.2019.07.021
None No relevant target permeability 5.1 10'-6 cm/s 10.1016/j.ejmech.2019.111737
None No relevant target permeability 5.1 ucm/s 10.1016/j.bmcl.2017.01.050
None No relevant target permeability 5.2 ucm/s 10.1021/jm500258v
None No relevant target permeability 5.3 10'-6 cm/s 10.1016/j.bmc.2016.06.045
None No relevant target permeability 5.3 10'-6 cm/s 10.1016/j.bmc.2019.01.040
None No relevant target permeability 5.3 10'-6 cm/s 10.1016/j.ejmech.2016.12.009
None No relevant target permeability 5.3 10'-6 cm/s 10.1016/j.ejmech.2017.02.034
None No relevant target permeability 5.3 10'-6 cm/s 10.1016/j.ejmech.2017.02.042
None No relevant target permeability 5.3 10'-6 cm/s 10.1016/j.ejmech.2017.08.025
None No relevant target permeability 5.3 10'-6 cm/s 10.1016/j.ejmech.2019.07.051
None No relevant target permeability 5.3 10'-6 cm/s 10.1016/j.ejmech.2019.111737
None No relevant target permeability 5.3 ucm/s 10.1016/j.bmcl.2017.01.050
None No relevant target permeability 5.5 ucm/s 10.1016/j.bmc.2017.02.027
None No relevant target permeability 5.9 ucm/s 10.1016/j.ejmech.2017.06.020
None No relevant target permeability 6.5 10'-6 cm/s 10.1016/j.ejmech.2019.07.051
None No relevant target permeability 9.5 10'-6 cm/s 10.1016/j.ejmech.2017.02.034
None No relevant target pKa 0.75 None 10.1021/jf102525e
None No relevant target pKa 8.0 None 10.1021/jm0000564
None No relevant target pKa 8.05 None 10.1016/j.ejmech.2009.06.004
None No relevant target pKa 8.05 None 10.1021/jm00072a012
None No relevant target pKa 8.05 None 10.1021/jm00111a020
None No relevant target pKa 8.05 None 10.1021/jm00230a014
None No relevant target pKa 8.05 None 10.1021/jm0200409
None No relevant target pKa 8.05 None 10.1021/jm030408h
None No relevant target pKa 8.14 None 10.1021/ml300326v
None No relevant target pKa 8.3 None 10.1124/dmd.110.035998
None Phospholipidosis Phospholipidosis nan None 10.1080/15376510701857262
None Unchecked Ac50 0.631 uM None
None Unchecked Ac50 5.012 uM None
None Unchecked AC50 631.0 nM None
None Unchecked AC50 5011.9 nM None
None Unchecked Activity nan None 10.1038/nchembio.79
None Unchecked Hepatotoxicity (acute) 0.0 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) 0.0 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 64.0 nM None
None Unchecked IC50 nan None None
None Unchecked Ki 16.5 nM 10.1016/j.bmc.2008.06.051
None Unchecked Ki 20.89 nM 10.1016/j.bmc.2008.07.033
None Unchecked Ki 20.89 nM 10.1021/jm800026x
None Unchecked Ki 43.0 nM None
None Unchecked Ki 364.5 nM 10.1016/j.bmc.2010.11.039
None Unchecked Ki 364.5 nM 10.1016/j.bmcl.2008.11.055
None Unchecked Ki 954.99 nM 10.1007/s00044-004-0023-9
None Unchecked Ki 10000.0 nM 10.1016/j.bmc.2012.06.008
None Unchecked Ki nan None None
None Unchecked Ratio 297.0 None 10.1021/jm990569e
None Unchecked Ratio EC50 8.9 None None
None Unchecked Ratio Ki 0.27 None 10.1021/jm501456p
None Unchecked Ratio pKi -0.5229 None 10.1016/j.bmc.2008.06.051
None Unchecked Selectivity ratio 4.0 None 10.1021/acsmedchemlett.6b00290

Metabolism Information