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Ligand

NameCHEMBL1822453
Molecular formulaC30H34N6O2
IUPAC nameN-(2-phenyl-2-piperidin-1-ylethyl)-4-(3-quinolin-2-yl-1,2,4-oxadiazol-5-yl)piperidine-1-carboxamide
Molecular weight510.642
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP4.4
SynonymsBDBM50352279
Inchi KeyAWUSEWFIOJHHGJ-UHFFFAOYSA-N
Inchi IDInChI=1S/C30H34N6O2/c37-30(31-21-27(23-10-3-1-4-11-23)35-17-7-2-8-18-35)36-19-15-24(16-20-36)29-33-28(34-38-29)26-14-13-22-9-5-6-12-25(22)32-26/h1,3-6,9-14,24,27H,2,7-8,15-21H2,(H,31,37)
PubChem CID56664980
ChEMBLCHEMBL1822453
IUPHARN/A
BindingDB50352279
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
16385Smoothened homologQ99835SMOHomo sapiens (Human)787

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