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Ligand

Name1-Cyclohexyl-1H-benzotriazole-5-carboxylic acid
Molecular formulaC13H15N3O2
IUPAC name1-cyclohexylbenzotriazole-5-carboxylic acid
Molecular weight245.282
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP2.6
SynonymsSMR000013711
1-Cyclohexyl-1H-1,2,3-benzotriazole-5-carboxylic acid
BAS 06332195
HMS2315I23
MLS000068125
[ Show all ]
Inchi KeyGLIAIPXYMCWRTG-UHFFFAOYSA-N
Inchi IDInChI=1S/C13H15N3O2/c17-13(18)9-6-7-12-11(8-9)14-15-16(12)10-4-2-1-3-5-10/h6-8,10H,1-5H2,(H,17,18)
PubChem CID653819
ChEMBLCHEMBL383099
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 1
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GLASS IDNameUniProtGeneSpeciesLength
99321Hydroxycarboxylic acid receptor 3P49019HCAR3Homo sapiens (Human)387

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