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Ligand

NameCHEMBL3923052
Molecular formulaC26H32FN3O2
IUPAC nameN-cyclohexyl-1-[[3-[(4-fluorobenzoyl)amino]phenyl]methyl]piperidine-4-carboxamide
Molecular weight437.559
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP4.3
SynonymsBDBM243541
US9428456, 1.156
Inchi KeyAKTXZYPQUJLYMA-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H32FN3O2/c27-22-11-9-20(10-12-22)25(31)29-24-8-4-5-19(17-24)18-30-15-13-21(14-16-30)26(32)28-23-6-2-1-3-7-23/h4-5,8-12,17,21,23H,1-3,6-7,13-16,18H2,(H,28,32)(H,29,31)
PubChem CID72704048
ChEMBLCHEMBL3923052
IUPHARN/A
BindingDB243541
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
533939Atypical chemokine receptor 3P25106ACKR3Homo sapiens (Human)362

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