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Ligand

NameCHEMBL1822295
Molecular formulaC29H31N5O2
IUPAC nameN-[(1-phenylcyclopentyl)methyl]-4-(3-quinolin-2-yl-1,2,4-oxadiazol-5-yl)piperidine-1-carboxamide
Molecular weight481.6
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP5.3
SynonymsBDBM50352289
Inchi KeyBRHTTYOSDMXFKQ-UHFFFAOYSA-N
Inchi IDInChI=1S/C29H31N5O2/c35-28(30-20-29(16-6-7-17-29)23-9-2-1-3-10-23)34-18-14-22(15-19-34)27-32-26(33-36-27)25-13-12-21-8-4-5-11-24(21)31-25/h1-5,8-13,22H,6-7,14-20H2,(H,30,35)
PubChem CID56668711
ChEMBLCHEMBL1822295
IUPHARN/A
BindingDB50352289
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
30995Smoothened homologQ99835SMOHomo sapiens (Human)787

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