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Ligand

NameCHEMBL231143
Molecular formulaC34H42F4N2O
IUPAC nameN-[[3-fluoro-5-(trifluoromethyl)phenyl]methyl]-1-hexyl-3-[(1S,3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentane-1-carboxamide
Molecular weight570.717
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP9.0
SynonymsBDBM50212123
N-{[3-fluoro-5-(trifluoromethyl)phenyl]methyl}-1-hexyl-3-[(1S,5''R)-5''-methylspiro[indene-1,4''-piperidine]-1''-yl]cyclopentane-1-carboxamide
Inchi KeyFONMXWMXXFXJLM-DQGLUBORSA-N
Inchi IDInChI=1S/C34H42F4N2O/c1-3-4-5-8-13-32(31(41)39-22-25-18-27(34(36,37)38)20-28(35)19-25)14-12-29(21-32)40-17-16-33(24(2)23-40)15-11-26-9-6-7-10-30(26)33/h6-7,9-11,15,18-20,24,29H,3-5,8,12-14,16-17,21-23H2,1-2H3,(H,39,41)/t24-,29?,32?,33+/m0/s1
PubChem CID44425650
ChEMBLCHEMBL231143
IUPHARN/A
BindingDB50212123
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
83428C-C chemokine receptor type 2P51683Ccr2Mus musculus (Mouse)373
83429C-C chemokine receptor type 2P41597CCR2Homo sapiens (Human)374

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