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Ligand

NameCHEMBL1773295
Molecular formulaC22H25N7O3S
IUPAC name5-[1-[1-(4-methylsulfonylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]piperidin-4-yl]-3-propan-2-yl-1,2,4-oxadiazole
Molecular weight467.548
Hydrogen bond acceptor9
Hydrogen bond donor0
XlogP3.2
SynonymsBDBM50343432
3-isopropyl-5-(1-(1-(4-(methylsulfonyl)phenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl)piperidin-4-yl)-1,2,4-oxadiazole
Inchi KeyBNVFIBOYMRSXMI-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H25N7O3S/c1-14(2)19-26-22(32-27-19)15-8-10-28(11-9-15)20-18-12-25-29(21(18)24-13-23-20)16-4-6-17(7-5-16)33(3,30)31/h4-7,12-15H,8-11H2,1-3H3
PubChem CID54586012
ChEMBLCHEMBL1773295
IUPHARN/A
BindingDB50343432
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: 1
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GLASS IDNameUniProtGeneSpeciesLength
28468Glucose-dependent insulinotropic receptorQ8TDV5GPR119Homo sapiens (Human)335

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