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Ligand

NameCHEMBL3288129
Molecular formulaC24H27ClN4O4S
IUPAC name1-(5-butanoyl-3-cyano-6-methylpyridin-2-yl)-N-[(4-chlorophenyl)methylsulfonyl]piperidine-4-carboxamide
Molecular weight503.014
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP3.4
SynonymsBDBM50019021
SCHEMBL3226279
Inchi KeyAIEZQZWTYKTYFP-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H27ClN4O4S/c1-3-4-22(30)21-13-19(14-26)23(27-16(21)2)29-11-9-18(10-12-29)24(31)28-34(32,33)15-17-5-7-20(25)8-6-17/h5-8,13,18H,3-4,9-12,15H2,1-2H3,(H,28,31)
PubChem CID44608149
ChEMBLCHEMBL3288129
IUPHARN/A
BindingDB50019021
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
6156P2Y purinoceptor 12Q9H244P2RY12Homo sapiens (Human)342

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