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name Structure Reference Source Properties Activities Metabolism

sulfadiazine

AlkaPlorer ID: AK020535

Synonym: None

IUPAC Name: 4-amino-N-pyrimidin-2-ylbenzenesulfonamide

Structure

SMILES: NC1=CC=C(S(=O)(=O)NC2=NC=CC=N2)C=C1

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InChI: InChI=1S/C10H10N4O2S/c11-8-2-4-9(5-3-8)17(15,16)14-10-12-6-1-7-13-10/h1-7H,11H2,(H,12,13,14)

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InChIKey: SEEPANYCNGTZFQ-UHFFFAOYSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Apis cerana Apis Apidae Hymenoptera Insecta Arthropoda Metazoa Eukaryota

Properties Information

Molecule Weight: 250.28300000000004

TPSA？: 97.97

MolLogP？: 0.8596000000000001

Number of H-Donors: 2

Number of H-Acceptors: 5

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
Acinetobacter baumannii Acinetobacter baumannii MIC 32.0 ug.mL-1 10.1016/j.bmcl.2022.128695
Bacillus subtilis Bacillus subtilis Inhibition 8.5 mm 10.1016/j.bmcl.2004.09.084
Bacillus subtilis Bacillus subtilis Inhibition 9.5 mm 10.1016/j.bmcl.2004.09.084
Bacillus subtilis Bacillus subtilis Inhibition 13.5 mm 10.1016/j.bmcl.2004.09.084
Bacillus subtilis Bacillus subtilis IZ 20.86 mm 10.1016/j.bmcl.2004.10.076
Bacillus subtilis Bacillus subtilis IZ 25.93 mm 10.1016/j.bmcl.2004.10.076
Bacillus subtilis Bacillus subtilis IZ 26.36 mm 10.1016/j.bmcl.2004.10.076
Bacillus subtilis Bacillus subtilis IZ 27.23 mm 10.1016/j.bmcl.2004.10.076
Bacillus subtilis Bacillus subtilis MIC 16.0 ug 10.1016/j.bmcl.2007.07.043
Bacillus subtilis Bacillus subtilis MIC 18.0 ug.mL-1 10.1016/j.bmc.2006.10.027
Bacillus subtilis Bacillus subtilis Zone of inhibition 20.8 mM 10.1016/j.bmcl.2003.08.017
Bacillus subtilis Bacillus subtilis Zone of inhibition 26.3 mM 10.1016/j.bmcl.2003.08.017
Bacillus subtilis Bacillus subtilis Zone of inhibition 26.9 mM 10.1016/j.bmcl.2003.08.017
Bacillus subtilis Bacillus subtilis Zone of inhibition 27.2 mM 10.1016/j.bmcl.2003.08.017
Bos taurus Progesterone receptor IC50 nan None None
Bos taurus Progesterone receptor Ki nan None None
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
Chlorocebus sabaeus Vero IC50 90000.0 nM 10.1016/j.bmcl.2005.03.048
Chlorocebus sabaeus Vero IC50 8000000.0 nM 10.1016/j.bmc.2007.09.025
Chlorocebus sabaeus Vero LD50 10.0 mM 10.1007/s00044-012-0347-9
Chlorocebus sabaeus Vero LD50 10.0 mM 10.1016/j.ejmech.2010.05.017
Enterococcus faecalis Enterococcus faecalis IZ 13.7 mm 10.1016/j.ejmech.2014.08.016
Enterococcus faecalis Enterococcus faecalis MIC 16.0 ug.mL-1 10.1016/j.bmcl.2022.128695
Enterococcus faecalis Enterococcus faecalis MIC 100000000.0 nM 10.1016/j.ejmech.2014.08.016
Enterococcus faecium Enterococcus faecium IC50 4000000.0 nM 10.1021/jm00212a010
Escherichia coli Escherichia coli GI 2.66 % 10.1016/j.bmcl.2014.01.065
Escherichia coli Escherichia coli GI 6.44 % 10.1016/j.bmcl.2014.01.065
Escherichia coli Escherichia coli GI 8.11 % 10.1016/j.bmcl.2014.01.065
Escherichia coli Escherichia coli IC50 12000.0 nM 10.1021/jm00212a010
Escherichia coli Escherichia coli Inhibition 8.5 mm 10.1016/j.bmcl.2004.09.084
Escherichia coli Escherichia coli Inhibition 9.5 mm 10.1016/j.bmcl.2004.09.084
Escherichia coli Escherichia coli Inhibition 12.5 mm 10.1016/j.bmcl.2004.09.084
Escherichia coli Escherichia coli Inhibition nan % 10.1021/jm00212a010
Escherichia coli Escherichia coli IZ 9.7 mm 10.1016/j.bmcl.2004.10.076
Escherichia coli Escherichia coli IZ 14.2 mm 10.1016/j.ejmech.2014.08.016
Escherichia coli Escherichia coli IZ 17.2 mm 10.1016/j.bmcl.2004.10.076
Escherichia coli Escherichia coli IZ 21.2 mm 10.1016/j.bmcl.2004.10.076
Escherichia coli Escherichia coli IZ 24.5 mm 10.1016/j.bmcl.2004.10.076
Escherichia coli Escherichia coli -Log C -0.08 None 10.1021/jm00361a014
Escherichia coli Escherichia coli -Log C 4.337 None 10.1021/jm00361a014
Escherichia coli Escherichia coli MIC 15.0 ug.mL-1 10.1016/j.bmc.2006.10.027
Escherichia coli Escherichia coli MIC 16.0 ug 10.1016/j.bmcl.2007.07.043
Escherichia coli Escherichia coli MIC 32.0 ug.mL-1 10.1016/j.bmcl.2022.128695
Escherichia coli Escherichia coli MIC 64.0 ug.mL-1 10.1016/j.bmcl.2022.128695
Escherichia coli Escherichia coli MIC 100000000.0 nM 10.1016/j.ejmech.2014.08.016
Escherichia coli Escherichia coli Zone of inhibition 9.7 mM 10.1016/j.bmcl.2003.08.017
Escherichia coli Escherichia coli Zone of inhibition 17.2 mM 10.1016/j.bmcl.2003.08.017
Escherichia coli Escherichia coli Zone of inhibition 22.2 mM 10.1016/j.bmcl.2003.08.017
Escherichia coli Escherichia coli Zone of inhibition 25.5 mM 10.1016/j.bmcl.2003.08.017
Escherichia coli K-12 Beta-lactamase AmpC Inhibition 5.0 % 10.1021/jm030191r
Escherichia coli K-12 Dihydropteroate synthase GII50 350.0 None 10.1021/jm00136a015
Homo sapiens Acetylcholinesterase IC50 nan None None
Homo sapiens Acetylcholinesterase Ki nan None None
Homo sapiens Adenosine A1 receptor AC50 10000.0 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 10000.0 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 10000.0 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 Alpha-1a adrenergic receptor AC50 10000.0 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 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 IC50 nan None None
Homo sapiens Beta-2 adrenergic receptor Ki nan None None
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 IC50 133000.0 nM 10.1093/toxsci/kft176
Homo sapiens Bile salt export pump IC50 135000.0 nM 10.1093/toxsci/kfq269
Homo sapiens Bile salt export pump IC50 1000000.0 nM 10.1124/dmd.112.047068
Homo sapiens Bradykinin B2 receptor AC50 10000.0 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 Calcitonin receptor IC50 nan None None
Homo sapiens Calcitonin receptor Ki nan None None
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 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 10000.0 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 Chromobox protein homolog 1 Potency 89125.1 nM None
Homo sapiens Chymotrypsin C Inhibition 5.0 % 10.1021/jm030191r
Homo sapiens Cyclooxygenase-1 IC50 nan None None
Homo sapiens Cyclooxygenase-1 Ki nan None None
Homo sapiens Cyclooxygenase-2 AC50 10000.0 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 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 2C9 AC50 nan None None
Homo sapiens Cytochrome P450 2C9 IC50 nan None None
Homo sapiens Cytochrome P450 2C9 Inhibition -17.1 % 10.1021/jm060706p
Homo sapiens Cytochrome P450 2C9 Ki nan None None
Homo sapiens Cytochrome P450 2D6 AC50 nan None None
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 3A4 AC50 nan None None
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 Dihydrofolate reductase IC50 130.0 nM 10.1039/d1md00280e
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 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 IC50 nan None None
Homo sapiens Endothelin receptor ET-A Ki nan None None
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 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Estrogen receptor alpha AC50 10000.0 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 IC50 nan None None
Homo sapiens Estrogen receptor beta Ki nan None None
Homo sapiens Geminin Potency 35481.3 nM None
Homo sapiens Ghrelin receptor AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Glucagon-like peptide 1 receptor Potency 7943.3 nM None
Homo sapiens Glucocorticoid receptor AC50 10000.0 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 HepG2 Potency 112.2 nM None
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 -1.33 % 10.6019/CHEMBL4808148
Homo sapiens Histone deacetylase 6 Inhibition 9.8 % 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 CL 0.2 mL.min-1.kg-1 10.1021/jm901371v
Homo sapiens Homo sapiens CL 0.55 mL.min-1.kg-1 10.1021/jm900403j
Homo sapiens Homo sapiens CL 0.55 mL.min-1.kg-1 10.1021/jm901371v
Homo sapiens Homo sapiens CL_renal 0.3 mL.min-1.kg-1 10.1021/jm901371v
Homo sapiens Homo sapiens CL_renal 0.34 mL.min-1.kg-1 10.1021/jm900403j
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 100.0 % 10.1021/jm901421c
Homo sapiens Homo sapiens Fa 0.85 None 10.1021/jm901371v
Homo sapiens Homo sapiens F_fraction 0.85 None 10.1021/jm901371v
Homo sapiens Homo sapiens Fg 1.01 None 10.1021/jm901371v
Homo sapiens Homo sapiens Fh 0.99 None 10.1021/jm901371v
Homo sapiens Homo sapiens Vdss 0.29 L.kg-1 10.1021/jm901371v
Homo sapiens Homo sapiens Vdss 0.92 L.kg-1 10.1016/j.ejmech.2009.06.004
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 10000.0 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 10000.0 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 Activity nan None 10.1021/jm800656v
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 30000.0 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 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 10000.0 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 IC50 nan None None
Homo sapiens Neuropeptide Y receptor type 2 Ki nan None None
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 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 Pregnane X receptor AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Prelamin-A/C Potency 177.8 nM None
Homo sapiens Progesterone receptor AC50 10000.0 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 kinase Aurora-A IC50 21000.0 nM 10.1021/jm8000373
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 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 Sigma opioid receptor IC50 nan None None
Homo sapiens Sigma opioid receptor Ki nan None None
Homo sapiens Solute carrier organic anion transporter family member 1B1 Inhibition 90.81 % 10.1124/mol.112.084152
Homo sapiens Solute carrier organic anion transporter family member 1B3 Inhibition 74.08 % 10.1124/mol.112.084152
Homo sapiens THP-1 GI 90.0 % 10.1016/s0960-894x(00)00112-8
Homo sapiens Thromboxane A2 receptor AC50 10000.0 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 Thyroid stimulating hormone receptor Potency 15848.9 nM None
Homo sapiens Transcriptional regulator ERG Potency 11220.2 nM None
Homo sapiens Type-1 angiotensin II receptor AC50 10000.0 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 10000.0 nM 10.1038/s41467-023-40064-9
Klebsiella pneumoniae Klebsiella pneumoniae Inhibition 12.5 mm 10.1016/j.bmcl.2004.09.084
Klebsiella pneumoniae Klebsiella pneumoniae Inhibition 13.5 mm 10.1016/j.bmcl.2004.09.084
Klebsiella pneumoniae Klebsiella pneumoniae Inhibition 15.0 mm 10.1016/j.bmcl.2004.09.084
Klebsiella pneumoniae Klebsiella pneumoniae IZ 25.63 mm 10.1016/j.bmcl.2004.10.076
Klebsiella pneumoniae Klebsiella pneumoniae IZ 27.03 mm 10.1016/j.bmcl.2004.10.076
Klebsiella pneumoniae Klebsiella pneumoniae IZ 29.23 mm 10.1016/j.bmcl.2004.10.076
Klebsiella pneumoniae Klebsiella pneumoniae IZ 29.53 mm 10.1016/j.bmcl.2004.10.076
Klebsiella pneumoniae Klebsiella pneumoniae MIC 64.0 ug 10.1016/j.bmcl.2007.07.043
Klebsiella pneumoniae Klebsiella pneumoniae MIC 256.0 ug.mL-1 10.1016/j.bmcl.2022.128695
Klebsiella pneumoniae Klebsiella pneumoniae Zone of inhibition 25.6 mM 10.1016/j.bmcl.2003.08.017
Klebsiella pneumoniae Klebsiella pneumoniae Zone of inhibition 27.0 mM 10.1016/j.bmcl.2003.08.017
Klebsiella pneumoniae Klebsiella pneumoniae Zone of inhibition 29.2 mM 10.1016/j.bmcl.2003.08.017
Klebsiella pneumoniae Klebsiella pneumoniae Zone of inhibition 29.5 mM 10.1016/j.bmcl.2003.08.017
Lacticaseibacillus casei Lacticaseibacillus casei IC50 4000000.0 nM 10.1021/jm00212a010
Leishmania donovani Leishmania donovani IC50 12040.0 nM 10.6019/CHEMBL3392926
Leishmania donovani Leishmania donovani IC50 125570.0 nM 10.6019/CHEMBL3392926
Leishmania infantum Leishmania infantum GI nan None 10.1016/j.bmc.2009.09.030
Leishmania infantum Leishmania infantum IC50 nan None 10.1016/j.bmc.2009.09.030
Mus musculus J774 IC50 nan None 10.1016/j.bmc.2009.09.030
Mus musculus L929 CC30 5000.0 uM 10.1016/j.ejmech.2019.111765
Mus musculus Nitric oxide synthase, inducible IC50 nan None None
Mus musculus Nitric oxide synthase, inducible Ki nan None None
Mycobacterium avium Mycobacterium avium MIC 62500.0 nM 10.1016/j.ejmech.2012.01.060
Mycobacterium kansasii Mycobacterium kansasii MIC 8000.0 nM 10.1016/j.ejmech.2012.01.060
Mycobacterium kansasii Mycobacterium kansasii MIC 16000.0 nM 10.1016/j.ejmech.2012.01.060
Mycobacterium kansasii Mycobacterium kansasii MIC 32000.0 nM 10.1016/j.ejmech.2012.01.060
Mycobacterium tuberculosis Mycobacterium tuberculosis MBC 128.0 ug ml-1 10.1016/j.bmc.2012.04.060
Mycobacterium tuberculosis Mycobacterium tuberculosis MIC 8.0 ug.mL-1 10.1016/j.bmc.2012.04.060
Mycobacterium tuberculosis Mycobacterium tuberculosis MIC 32000.0 nM 10.1016/j.ejmech.2012.01.060
Mycobacterium tuberculosis Mycobacterium tuberculosis MIC 62500.0 nM 10.1016/j.ejmech.2012.01.060
Neisseria meningitidis Neisseria meningitidis Activity 0.0 % 10.1128/aac.00994-08
Neisseria meningitidis Neisseria meningitidis Activity 6.0 % 10.1128/aac.00994-08
Neisseria meningitidis Neisseria meningitidis Activity 94.0 % 10.1128/aac.00994-08
Neisseria meningitidis Neisseria meningitidis MIC 1.5 ug.mL-1 10.1128/aac.00994-08
Neisseria meningitidis Neisseria meningitidis MIC50 256.0 ug.mL-1 10.1128/aac.00994-08
Neisseria meningitidis Neisseria meningitidis MIC90 256.0 ug.mL-1 10.1128/aac.00994-08
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
Pasteurella multocida Pasteurella multocida IZ 28.0 mm 10.1016/j.bmcl.2006.11.001
Pasteurella multocida Pasteurella multocida IZ 30.0 mm 10.1016/j.bmcl.2006.11.001
Pasteurella multocida Pasteurella multocida IZ 39.0 mm 10.1016/j.bmcl.2006.11.001
Plasmodium berghei Plasmodium berghei MCD 640.0 mg kg-1 10.1021/jm00212a010
Plasmodium berghei Plasmodium berghei MED 160.0 mg kg-1 10.1021/jm00212a010
Plasmodium falciparum Plasmodium falciparum IC50 1440.0 nM 10.6019/CHEMBL3392926
Plasmodium falciparum Plasmodium falciparum Potency 73.8 nM None
Pseudomonas aeruginosa Pseudomonas aeruginosa Inhibition nan None 10.1016/j.bmcl.2004.09.084
Pseudomonas aeruginosa Pseudomonas aeruginosa MIC 8.0 ug.mL-1 10.1016/j.bmcl.2022.128695
Pseudomonas aeruginosa Pseudomonas aeruginosa MIC 22.0 ug.mL-1 10.1016/j.bmc.2006.10.027
Pseudomonas aeruginosa Pseudomonas aeruginosa MIC 32.0 ug 10.1016/j.bmcl.2007.07.043
Pseudomonas aeruginosa Pseudomonas aeruginosa MIC 64.0 ug.mL-1 10.1016/j.bmcl.2022.128695
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 10000.0 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 Cyclooxygenase-1 AC50 10000.0 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 Insulin receptor IC50 nan None None
Rattus norvegicus Insulin receptor Ki nan None None
Rattus norvegicus Nitric-oxide synthase, brain IC50 nan None None
Rattus norvegicus Nitric-oxide synthase, brain Ki nan None None
Rattus norvegicus Peripheral myelin protein 22 Potency 6911.1 nM None
Rattus norvegicus Plasma Fu 0.44 None 10.1021/jm901371v
Rattus norvegicus Plasma logFu 0.55 None 10.1016/j.ejmech.2009.06.004
Rattus norvegicus Rattus norvegicus ALB 35700.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALB 36000.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALB 37300.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALB 37500.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALB 39000.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALP 285.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALP 328.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALP 329.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALP 378.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALP 393.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALP 399.83 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALT 33.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALT 36.83 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALT 37.67 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALT 39.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALT 43.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus AST 54.67 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus AST 55.67 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus AST 56.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus AST 59.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus AST 62.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus AST 66.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BASOLE 0.0 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BILI 3.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BILI 4.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BILI 5.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BILI 7.2 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BILI 11.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BUN 113.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BUN 116.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BUN 126.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BUN 140.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BUN 146.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BUN 163.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHLORIDE 101.67 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHLORIDE 102.0 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHLORIDE 104.0 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHOL 655.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHOL 663.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHOL 686.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHOL 733.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHOL 803.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CK 110.67 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CK 111.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CK 129.67 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CK 130.67 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CK 134.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CK 139.5 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CREAT 5.8 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CREAT 6.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CREAT 6.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CREAT 9.2 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOSLE 0.0 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOSLE 0.2 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOSLE 0.33 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOSLE 0.5 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus GLUC 1750.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus GLUC 1806.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus GLUC 1816.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus GLUC 1860.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus GLUC 1876.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HCT 35.07 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HCT 35.77 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HCT 36.37 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HCT 36.48 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HCT 36.67 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HCT 40.3 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HGB 141200.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HGB 141700.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HGB 142000.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HGB 143000.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HGB 143800.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HGB 156000.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYMLE 82.33 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYMLE 83.0 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYMLE 84.0 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYMLE 88.33 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYMLE 90.0 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCH 23.1 pg 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCH 23.33 pg 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCH 23.9 pg 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCH 23.92 pg 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCH 24.17 pg 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCH 24.38 pg 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCHC 386300.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCHC 388000.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCHC 393300.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCHC 394400.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCHC 396700.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCHC 402800.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCV 58.17 fL 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCV 60.3 fL 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCV 60.52 fL 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCV 60.66 fL 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCV 61.37 fL 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCV 61.57 fL 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONOLE 1.0 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONOLE 2.0 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONOLE 2.67 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONOLE 3.0 % 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 13.8 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTLE 14.0 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTLE 14.5 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTLE 14.67 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PHOS 112.8 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PHOS 114.2 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PHOS 119.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PHOS 119.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PHOS 121.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PHOS 125.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PLAT 911500.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PLAT 1086330.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PLAT 1166000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PLAT 1172330.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PLAT 1190600.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PLAT 1254670.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus POTASSIUM 6.8 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus POTASSIUM 6.9 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus POTASSIUM 7.0 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus POTASSIUM 7.03 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus POTASSIUM 7.05 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus POTASSIUM 7.23 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PROT 63300.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PROT 65000.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PROT 68300.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PROT 68700.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PROT 70300.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus RBC 5800000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus RBC 5930000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus RBC 6020000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus RBC 6080000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus RBC 6150000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus RBC 6550000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus SODIUM 148.17 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus SODIUM 148.5 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus SODIUM 148.67 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus SODIUM 149.67 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus SODIUM 150.33 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus SODIUM 151.33 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus Tissue Severity Score nan None 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus WBC 12130.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus WBC 12340.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus WBC 12630.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus WBC 13700.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus WBC 14470.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus WBC 14830.0 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 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 Voltage-gated L-type calcium channel alpha-1C subunit AC50 10000.0 nM 10.1038/s41467-023-40064-9
Salmonella enterica subsp. enterica serovar Enteritidis Salmonella enteritidis IZ 10.0 mm 10.1016/j.bmcl.2006.11.001
Salmonella enterica subsp. enterica serovar Enteritidis Salmonella enteritidis IZ 15.0 mm 10.1016/j.bmcl.2006.11.001
Salmonella enterica subsp. enterica serovar Enteritidis Salmonella enteritidis IZ 20.0 mm 10.1016/j.bmcl.2006.11.001
Salmonella enterica subsp. enterica serovar Typhimurium Salmonella typhimurium IZ 15.0 mm 10.1016/j.ejmech.2014.08.016
Salmonella enterica subsp. enterica serovar Typhimurium Salmonella typhimurium MIC 50000000.0 nM 10.1016/j.ejmech.2014.08.016
Severe acute respiratory syndrome coronavirus 2 Replicase polyprotein 1ab Inhibition 15.43 % 10.6019/CHEMBL4495564
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 -3.32 % 10.21203/rs.3.rs-23951/v1
Severe acute respiratory syndrome coronavirus 2 SARS-CoV-2 Inhibition -0.11 % 10.6019/CHEMBL4495565
Severe acute respiratory syndrome coronavirus 2 SARS-CoV-2 Inhibition index -0.0006413 None 10.1101/2020.04.03.023846
Staphylococcus aureus Staphylococcus aureus GI -6.47 % 10.1016/j.bmcl.2014.01.065
Staphylococcus aureus Staphylococcus aureus GI 2.17 % 10.1016/j.bmcl.2014.01.065
Staphylococcus aureus Staphylococcus aureus GI 18.13 % 10.1016/j.bmcl.2014.01.065
Staphylococcus aureus Staphylococcus aureus Inhibition 7.0 mm 10.1016/j.bmcl.2004.09.084
Staphylococcus aureus Staphylococcus aureus Inhibition 7.5 mm 10.1016/j.bmcl.2004.09.084
Staphylococcus aureus Staphylococcus aureus Inhibition 9.5 mm 10.1016/j.bmcl.2004.09.084
Staphylococcus aureus Staphylococcus aureus IZ 18.3 mm 10.1016/j.ejmech.2014.08.016
Staphylococcus aureus Staphylococcus aureus MIC 16.0 ug.mL-1 10.1016/j.bmcl.2022.128695
Staphylococcus aureus Staphylococcus aureus MIC 64.0 ug.mL-1 10.1016/j.bmcl.2022.128695
Staphylococcus aureus Staphylococcus aureus MIC 500000.0 nM 10.1016/j.ejmech.2012.01.060
Staphylococcus aureus Staphylococcus aureus MIC 6250000.0 nM 10.1016/j.ejmech.2014.08.016
Staphylococcus epidermidis Staphylococcus epidermidis MIC 20.0 ug.mL-1 10.1016/j.bmc.2006.10.027
Staphylococcus epidermidis Staphylococcus epidermidis MIC 32.0 ug 10.1016/j.bmcl.2007.07.043
Staphylococcus epidermidis Staphylococcus epidermidis MIC 500000.0 nM 10.1016/j.ejmech.2012.01.060
Streptococcus pneumoniae Streptococcus pneumoniae IZ 14.2 mm 10.1016/j.ejmech.2014.08.016
Streptococcus pneumoniae Streptococcus pneumoniae MIC 100000000.0 nM 10.1016/j.ejmech.2014.08.016
Sus scrofa Malate dehydrogenase mitochondrial Inhibition 5.0 % 10.1021/jm030191r
Toxoplasma gondii Toxoplasma gondii Activity 0.0 % 10.1016/j.bmc.2007.09.025
Toxoplasma gondii Toxoplasma gondii Activity 6.84 % 10.1016/j.bmc.2007.09.025
Toxoplasma gondii Toxoplasma gondii Activity 8.0 None 10.1016/j.ejmech.2022.114812
Toxoplasma gondii Toxoplasma gondii Activity 29.55 % 10.1016/j.bmc.2007.09.025
Toxoplasma gondii Toxoplasma gondii Activity 36.0 % 10.1016/j.ejmech.2010.05.017
Toxoplasma gondii Toxoplasma gondii Activity 46.0 % 10.1016/j.bmc.2010.04.003
Toxoplasma gondii Toxoplasma gondii Activity 48.0 % 10.1016/j.ejmech.2010.05.017
Toxoplasma gondii Toxoplasma gondii Activity 48.71 % 10.1016/j.bmc.2007.09.025
Toxoplasma gondii Toxoplasma gondii Activity 53.0 % 10.1016/j.bmc.2010.04.003
Toxoplasma gondii Toxoplasma gondii Activity 53.84 % 10.1016/j.bmc.2007.09.025
Toxoplasma gondii Toxoplasma gondii Activity 58.0 % 10.1016/j.bmc.2010.04.003
Toxoplasma gondii Toxoplasma gondii Activity 64.0 % 10.1016/j.ejmech.2010.05.017
Toxoplasma gondii Toxoplasma gondii Activity 93.0 % 10.1016/j.bmc.2010.04.003
Toxoplasma gondii Toxoplasma gondii Activity 98.0 % 10.1016/j.bmc.2010.04.003
Toxoplasma gondii Toxoplasma gondii Activity 100.0 % 10.1016/j.bmc.2010.04.003
Toxoplasma gondii Toxoplasma gondii Activity 102.0 % 10.1016/j.bmc.2010.04.003
Toxoplasma gondii Toxoplasma gondii Activity nan None 10.1016/j.ejmech.2022.114812
Toxoplasma gondii Toxoplasma gondii IC50 2.95 ug.mL-1 10.1128/aac.01203-07
Toxoplasma gondii Toxoplasma gondii IC50 4.28 ug.mL-1 10.1128/aac.01203-07
Toxoplasma gondii Toxoplasma gondii IC50 4.9 ug.mL-1 10.1128/aac.01203-07
Toxoplasma gondii Toxoplasma gondii IC50 5.35 ug.mL-1 10.1128/aac.01203-07
Toxoplasma gondii Toxoplasma gondii IC50 6.26 ug.mL-1 10.1128/aac.01203-07
Toxoplasma gondii Toxoplasma gondii IC50 6.52 ug.mL-1 10.1128/aac.01203-07
Toxoplasma gondii Toxoplasma gondii IC50 6.55 ug.mL-1 10.1128/aac.01203-07
Toxoplasma gondii Toxoplasma gondii IC50 6.7 ug.mL-1 10.1128/aac.01203-07
Toxoplasma gondii Toxoplasma gondii IC50 9.25 ug.mL-1 10.1128/aac.01203-07
Toxoplasma gondii Toxoplasma gondii IC50 9.65 ug.mL-1 10.1128/aac.01203-07
Toxoplasma gondii Toxoplasma gondii IC50 14.95 ug.mL-1 10.1128/aac.01203-07
Toxoplasma gondii Toxoplasma gondii IC50 16.85 ug.mL-1 10.1128/aac.01203-07
Toxoplasma gondii Toxoplasma gondii IC50 18.8 ug.mL-1 10.1128/aac.01203-07
Toxoplasma gondii Toxoplasma gondii IC50 50.0 ug.mL-1 10.1128/aac.01203-07
Toxoplasma gondii Toxoplasma gondii IC50 70.0 ug.mL-1 10.1021/acs.jmedchem.1c01569
Toxoplasma gondii Toxoplasma gondii IC50 500.0 ug.mL-1 10.1021/acs.jmedchem.1c01569
Toxoplasma gondii Toxoplasma gondii IC50 1024.69 ug.mL-1 10.1021/acs.jmedchem.1c01569
Toxoplasma gondii Toxoplasma gondii IC50 26050.0 nM 10.1021/acs.jmedchem.1c01569
Toxoplasma gondii Toxoplasma gondii IC50 41200.0 nM 10.1021/jm800201s
Toxoplasma gondii Toxoplasma gondii IC50 100000.0 nM 10.1016/j.bmcl.2005.03.048
Toxoplasma gondii Toxoplasma gondii IC50 3000000.0 nM 10.1016/j.bmc.2007.09.025
Toxoplasma gondii Toxoplasma gondii IC50 10873710.0 nM 10.1016/j.ejmech.2019.111765
Toxoplasma gondii Toxoplasma gondii IC50 12978050.0 nM 10.1016/j.ejmech.2019.111765
Toxoplasma gondii Toxoplasma gondii IC50 nan None 10.1128/aac.01203-07
Toxoplasma gondii Toxoplasma gondii LD50 6.0 mM 10.1007/s00044-012-0347-9
Toxoplasma gondii Toxoplasma gondii LD50 6.0 mM 10.1016/j.ejmech.2010.05.017
Toxoplasma gondii Toxoplasma gondii Survival 46.4 % 10.1021/jm800201s
Toxoplasma gondii Toxoplasma gondii Survival 46.6 % 10.1021/jm030537y
Toxoplasma gondii Toxoplasma gondii Survival 59.2 % 10.1021/jm030537y
Toxoplasma gondii Toxoplasma gondii Survival 59.8 % 10.1021/jm800201s
Toxoplasma gondii Toxoplasma gondii Survival 64.5 % 10.1021/jm030537y
Toxoplasma gondii Toxoplasma gondii Survival 64.8 % 10.1021/jm800201s
Toxoplasma gondii Toxoplasma gondii Survival 74.6 % 10.1021/jm800201s
Toxoplasma gondii Toxoplasma gondii Survival 75.7 % 10.1021/jm030537y
Toxoplasma gondii Toxoplasma gondii Survival 100.0 % 10.1021/jm030537y
Trypanosoma brucei rhodesiense Trypanosoma brucei rhodesiense IC50 18450.0 nM 10.6019/CHEMBL3392926
Trypanosoma cruzi Trypanosoma cruzi IC50 24870.0 nM 10.6019/CHEMBL3392926
Vibrio Vibrio MIC 13.0 ug.mL-1 10.1016/j.bmc.2006.10.027
Vibrio sp. Vibrio sp. MIC 16.0 ug 10.1016/j.bmcl.2007.07.043
None ADMET Activity nan None 10.1016/j.ejmech.2022.114812
None ADMET CL 0.55 mL.min-1.kg-1 10.1124/dmd.108.020479
None ADMET delta logD 0.65 None 10.1021/jm0000564
None ADMET F 80.0 % 10.1021/jm0000564
None ADMET IC50 27300.0 nM 10.1016/j.bmc.2010.04.003
None ADMET -Log alpha -2.99 None 10.1021/jm00361a014
None ADMET log Ks 2.52 None 10.1016/j.bmc.2008.11.040
None ADMET log Pe -6.2 None 10.1021/jm0611105
None ADMET MRT 8.8 hr 10.1124/dmd.108.020479
None ADMET permeability 1.2 10'-6 cm/s 10.1021/jm901421c
None ADMET Survival 98.2 % 10.1021/jm800201s
None ADMET Survival 99.8 % 10.1021/jm800201s
None ADMET Survival 102.0 % 10.1021/jm800201s
None ADMET T1/2 7.0 hr 10.1124/dmd.108.020479
None ADMET Vdss 0.29 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 nan None 10.2174/1570163043334794
None Hepatotoxicity Alkaline Phosphatase Increase - Number of Reports nan 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 nan None 10.2174/1570163043334794
None Hepatotoxicity GGT Increase - Number of Reports nan 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 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 nan None 10.2174/1570163043334794
None Hepatotoxicity SGPT Increase - Number of Reports nan None 10.2174/1570163043334794
None NON-PROTEIN TARGET Fu 0.44 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) 2.0 None 10.1016/s0399-8320(04)95062-2
None NON-PROTEIN TARGET Hepatotoxicity (moderate) 2.7 % 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 20620.0 nM 10.6019/CHEMBL3392926
None NON-PROTEIN TARGET IC50 40120.0 nM 10.6019/CHEMBL3392926
None NON-PROTEIN TARGET IC50 4000000.0 nM 10.1021/jm00212a010
None NON-PROTEIN TARGET Inhibition 7.0 mm 10.1016/j.bmcl.2004.09.084
None NON-PROTEIN TARGET Inhibition 7.5 mm 10.1016/j.bmcl.2004.09.084
None NON-PROTEIN TARGET Inhibition 9.0 mm 10.1016/j.bmcl.2004.09.084
None NON-PROTEIN TARGET Potency 29.8 nM None
None NON-PROTEIN TARGET Potency 1677.4 nM None
None NON-PROTEIN TARGET Potency 2658.6 nM None
None No relevant target log1/S0 3.67 None 10.1016/j.ejmech.2007.04.009
None No relevant target LogD -0.39 None 10.1021/jm0000564
None No relevant target Log K 0.223 None 10.1021/jm00361a014
None No relevant target LogP -0.13 None 10.1016/j.ejmech.2007.04.009
None No relevant target LogP -0.12 None 10.1021/jm0611105
None No relevant target LogP -0.08 None 10.1021/jm901421c
None No relevant target pKa 6.37 None 10.1021/jm00136a015
None No relevant target pKa 6.4 None 10.1016/j.ejmech.2009.06.004
None No relevant target pKa 6.5 None 10.1021/jm0000564
None No relevant target pKa 6.52 None 10.1021/jm00361a014
None No relevant target pKa_A1 6.29 None 10.6019/CHEMBL3301361
None No relevant target Solubility 40.0 ug.mL-1 10.1016/j.bmc.2008.03.057
None Unchecked EII50 2.56 None 10.1021/jm00136a015
None Unchecked Hepatotoxicity (acute) 8.0 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) 1.0 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) 3.0 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) 1.0 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 537060.0 nM 10.1021/acs.jmedchem.1c01569
None Unchecked IC50 nan None None
None Unchecked Ki nan None None
None Unchecked Potency 36625.7 nM None
None Unchecked Selectivity ratio 0.39 None 10.1016/j.ejmech.2019.111765
None Unchecked Selectivity ratio 0.46 None 10.1016/j.ejmech.2019.111765
None Unchecked Survival 98.2 % 10.1021/jm030537y
None Unchecked Survival 99.7 % 10.1021/jm030537y
None Unchecked Survival 99.8 % 10.1021/jm030537y
None Unchecked Survival 100.0 % 10.1021/jm030537y

Metabolism Information

AKRT ID Reaction Reaction Link ID
AKRT004740 CC(=O)[CoA].Nc1ccc(S(=O)(=O)Nc2ncccn2)cc1>>CC(=O)Nc1ccc(S(=O)(=O)Nc2ncccn2)cc1 enzymemap_28559