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Ligand

NameCHEMBL338624
Molecular formulaC36H37ClF3N3O2
IUPAC name1-[5-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-2,2-diphenylpentyl]-3-[3-(trifluoromethyl)phenyl]urea
Molecular weight636.156
Hydrogen bond acceptor6
Hydrogen bond donor3
XlogP7.8
SynonymsBDBM50117398
1-{5-[4-(4-Chloro-phenyl)-4-hydroxy-piperidin-1-yl]-2,2-diphenyl-pentyl}-3-(3-trifluoromethyl-phenyl)-urea
Inchi KeyBRPKVWBIDATEPI-UHFFFAOYSA-N
Inchi IDInChI=1S/C36H37ClF3N3O2/c37-31-17-15-29(16-18-31)35(45)20-23-43(24-21-35)22-8-19-34(27-9-3-1-4-10-27,28-11-5-2-6-12-28)26-41-33(44)42-32-14-7-13-30(25-32)36(38,39)40/h1-7,9-18,25,45H,8,19-24,26H2,(H2,41,42,44)
PubChem CID11814253
ChEMBLCHEMBL338624
IUPHARN/A
BindingDB50117398
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
31214C-C chemokine receptor type 1P32246CCR1Homo sapiens (Human)355
31215C-C chemokine receptor type 3P51677CCR3Homo sapiens (Human)355

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