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Ligand

NameCGP-49823
Molecular formulaC31H33N3O
IUPAC name[(2R,4S)-2-benzyl-4-(quinolin-4-ylmethylamino)piperidin-1-yl]-(3,5-dimethylphenyl)methanone
Molecular weight463.625
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP6.0
Synonyms150705-88-7
BDBM50287397
cgp49823
CHEMBL290364
D0N1PA
[ Show all ]
Inchi KeyWQZUOBIIPDZRJP-WUFINQPMSA-N
Inchi IDInChI=1S/C31H33N3O/c1-22-16-23(2)18-26(17-22)31(35)34-15-13-27(20-28(34)19-24-8-4-3-5-9-24)33-21-25-12-14-32-30-11-7-6-10-29(25)30/h3-12,14,16-18,27-28,33H,13,15,19-21H2,1-2H3/t27-,28+/m0/s1
PubChem CID9869033
ChEMBLCHEMBL290364
IUPHARN/A
BindingDB50287397
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
380174Neuromedin-K receptorP29371TACR3Homo sapiens (Human)465
380175Substance-K receptorP05363TACR2Bos taurus (Bovine)384
380173Substance-P receptorP25103TACR1Homo sapiens (Human)407

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