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Ligand

NameCHEMBL3115775
Molecular formulaC21H28ClNO3
IUPAC name5-(5-chloro-2-hexyl-1-methylindol-3-yl)-3-methyl-5-oxopentanoic acid
Molecular weight377.909
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP5.4
SynonymsBDBM50446952
SCHEMBL287150
3-Methyl-5-oxo-5-(1-methyl-2-hexyl-5-chloro-1H-indole-3-yl)pentanoic acid
Inchi KeyXDSPQHGHALVRAI-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H28ClNO3/c1-4-5-6-7-8-18-21(19(24)11-14(2)12-20(25)26)16-13-15(22)9-10-17(16)23(18)3/h9-10,13-14H,4-8,11-12H2,1-3H3,(H,25,26)
PubChem CID66644128
ChEMBLCHEMBL3115775
IUPHARN/A
BindingDB50446952
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
389226Oxoeicosanoid receptor 1Q8TDS5OXER1Homo sapiens (Human)423

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