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Ligand

NameCHEMBL1224608
Molecular formulaC24H27N5O4
IUPAC name2-amino-N-[2-[3-[2-(cyclopropylmethylamino)-2-oxoethyl]-4-oxo-2-phenylquinazolin-6-yl]oxyethyl]acetamide
Molecular weight449.511
Hydrogen bond acceptor6
Hydrogen bond donor3
XlogP1.0
SynonymsBDBM50325827
2-amino-N-(2-(3-(2-(cyclopropylmethylamino)-2-oxoethyl)-4-oxo-2-phenyl-3,4-dihydroquinazolin-6-yloxy)ethyl)acetamide
Inchi KeyBSHQGACATZYJOG-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H27N5O4/c25-13-21(30)26-10-11-33-18-8-9-20-19(12-18)24(32)29(15-22(31)27-14-16-6-7-16)23(28-20)17-4-2-1-3-5-17/h1-5,8-9,12,16H,6-7,10-11,13-15,25H2,(H,26,30)(H,27,31)
PubChem CID49866220
ChEMBLCHEMBL1224608
IUPHARN/A
BindingDB50325827
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
31670Vasopressin V1b receptorP47901AVPR1BHomo sapiens (Human)424

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