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Ligand

NameCHEMBL259114
Molecular formulaC24H23N7O
IUPAC name2-butyl-1-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]pyrazolo[3,4-b]pyridin-3-one
Molecular weight425.496
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP4.3
SynonymsBDBM50376928
Inchi KeyBWKIOYBQMPZRBR-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H23N7O/c1-2-3-15-30-24(32)21-9-6-14-25-23(21)31(30)16-17-10-12-18(13-11-17)19-7-4-5-8-20(19)22-26-28-29-27-22/h4-14H,2-3,15-16H2,1H3,(H,26,27,28,29)
PubChem CID24827770
ChEMBLCHEMBL259114
IUPHARN/A
BindingDB50376928
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
34515Type-1 angiotensin II receptorP34976AGTR1Oryctolagus cuniculus (Rabbit)359
34516Type-1A angiotensin II receptorP25095Agtr1Rattus norvegicus (Rat)359

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