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Ligand

NameCHEMBL1778939
Molecular formulaC30H30N4O2
IUPAC name2-[6-[3-(azetidin-1-ylmethyl)phenyl]-4-oxo-2-phenylquinazolin-3-yl]-N-(cyclopropylmethyl)acetamide
Molecular weight478.596
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP4.2
SynonymsBDBM50345034
2-(6-(3-(azetidin-1-ylmethyl)phenyl)-4-oxo-2-phenylquinazolin-3(4H)-yl)-N-(cyclopropylmethyl)acetamide
Inchi KeyAUCAWWLYHRHMIO-UHFFFAOYSA-N
Inchi IDInChI=1S/C30H30N4O2/c35-28(31-18-21-10-11-21)20-34-29(23-7-2-1-3-8-23)32-27-13-12-25(17-26(27)30(34)36)24-9-4-6-22(16-24)19-33-14-5-15-33/h1-4,6-9,12-13,16-17,21H,5,10-11,14-15,18-20H2,(H,31,35)
PubChem CID54580830
ChEMBLCHEMBL1778939
IUPHARN/A
BindingDB50345034
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
14501Vasopressin V1b receptorP47901AVPR1BHomo sapiens (Human)424

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