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Ligand

NameCHEMBL3985336
Molecular formulaC27H34ClN3O2
IUPAC name1-[[3-[[2-(2-chlorophenyl)acetyl]amino]phenyl]methyl]-N-cyclohexylpiperidine-4-carboxamide
Molecular weight468.038
Hydrogen bond acceptor3
Hydrogen bond donor2
XlogP4.7
SynonymsBDBM243506
US9428456, 1.025
Inchi KeyASSGWVBTWBZKGL-UHFFFAOYSA-N
Inchi IDInChI=1S/C27H34ClN3O2/c28-25-12-5-4-8-22(25)18-26(32)29-24-11-6-7-20(17-24)19-31-15-13-21(14-16-31)27(33)30-23-9-2-1-3-10-23/h4-8,11-12,17,21,23H,1-3,9-10,13-16,18-19H2,(H,29,32)(H,30,33)
PubChem CID129625953
ChEMBLCHEMBL3985336
IUPHARN/A
BindingDB243506
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
533971Atypical chemokine receptor 3P25106ACKR3Homo sapiens (Human)362

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