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Ligand

NameCHEMBL3115783
Molecular formulaC21H29NO3
IUPAC name5-(2-hexyl-3-methylindol-1-yl)-3-methyl-5-oxopentanoic acid
Molecular weight343.467
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP5.3
SynonymsBDBM50446964
3-Methyl-5-oxo-5-(2-hexyl-3-methyl-1H-indole-1-yl)pentanoic acid
Inchi KeyIOLXGBRXPNGLCP-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H29NO3/c1-4-5-6-7-11-18-16(3)17-10-8-9-12-19(17)22(18)20(23)13-15(2)14-21(24)25/h8-10,12,15H,4-7,11,13-14H2,1-3H3,(H,24,25)
PubChem CID76336045
ChEMBLCHEMBL3115783
IUPHARN/A
BindingDB50446964
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
138015Oxoeicosanoid receptor 1Q8TDS5OXER1Homo sapiens (Human)423

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