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Ligand

NameCHEMBL3681889
Molecular formulaC28H32F3N5O2
IUPAC name4-[2-amino-1-[[4-(1H-indol-3-yl)cyclohexyl]amino]-2-oxoethyl]-N-(3,4,5-trifluorophenyl)piperidine-1-carboxamide
Molecular weight527.592
Hydrogen bond acceptor6
Hydrogen bond donor4
XlogP3.8
SynonymsUS8921559, 30
BDBM141937
SCHEMBL10082538
Inchi KeyAXBPZRPCHGVPAW-UHFFFAOYSA-N
Inchi IDInChI=1S/C28H32F3N5O2/c29-22-13-19(14-23(30)25(22)31)35-28(38)36-11-9-17(10-12-36)26(27(32)37)34-18-7-5-16(6-8-18)21-15-33-24-4-2-1-3-20(21)24/h1-4,13-18,26,33-34H,5-12H2,(H2,32,37)(H,35,38)
PubChem CID57344320
ChEMBLCHEMBL3681889
IUPHARN/A
BindingDB141937
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
464928C-C chemokine receptor type 2P41597CCR2Homo sapiens (Human)374

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