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Ligand

NameCHEMBL230932
Molecular formulaC30H34F4N2O
IUPAC name1-ethyl-N-[[3-fluoro-5-(trifluoromethyl)phenyl]methyl]-3-[(1S,3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentane-1-carboxamide
Molecular weight514.609
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP6.9
SynonymsBDBM50212146
1-ethyl-N-{[3-fluoro-5-(trifluoromethyl)phenyl]methyl}-3-[(1S,5''R)-5''-methylspiro[indene-1,4''-piperidine]-1''-yl]cyclopentane-1-carboxamide
Inchi KeyWZPMKCZRNPIWHY-FYZPOUGESA-N
Inchi IDInChI=1S/C30H34F4N2O/c1-3-28(27(37)35-18-21-14-23(30(32,33)34)16-24(31)15-21)10-9-25(17-28)36-13-12-29(20(2)19-36)11-8-22-6-4-5-7-26(22)29/h4-8,11,14-16,20,25H,3,9-10,12-13,17-19H2,1-2H3,(H,35,37)/t20-,25?,28?,29+/m0/s1
PubChem CID44425644
ChEMBLCHEMBL230932
IUPHARN/A
BindingDB50212146
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
386429C-C chemokine receptor type 2P41597CCR2Homo sapiens (Human)374
386430C-C chemokine receptor type 2P51683Ccr2Mus musculus (Mouse)373

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