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Ligand

NameCHEMBL3092412
Molecular formulaC28H33N3O2
IUPAC name(3S,4R)-4-(3-methoxyphenyl)-1-(2-phenylethyl)-N-(2-pyridin-2-ylethyl)piperidine-3-carboxamide
Molecular weight443.591
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP4.3
SynonymsBDBM50443619
Inchi KeyBHJGJZILMGKCDE-RRPNLBNLSA-N
Inchi IDInChI=1S/C28H33N3O2/c1-33-25-12-7-10-23(20-25)26-15-19-31(18-14-22-8-3-2-4-9-22)21-27(26)28(32)30-17-13-24-11-5-6-16-29-24/h2-12,16,20,26-27H,13-15,17-19,21H2,1H3,(H,30,32)/t26-,27+/m0/s1
PubChem CID76317176
ChEMBLCHEMBL3092412
IUPHARN/A
BindingDB50443619
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
23795G-protein coupled receptor 39O43194GPR39Homo sapiens (Human)453

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