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Ligand

NameCHEMBL20223
Molecular formulaC21H16N2OS
IUPAC name(3E)-1-methyl-5-phenyl-3-(thiophen-3-ylmethylidene)-1,4-benzodiazepin-2-one
Molecular weight344.432
Hydrogen bond acceptor3
Hydrogen bond donor0
XlogP4.4
SynonymsSCHEMBL9525630
(Z)-1-Methyl-5-phenyl-3-thiophen-3-ylmethylene-1,3-dihydro-benzo[e][1,4]diazepin-2-one
BDBM50019817
Inchi KeyBLZAGSMIZITJHD-QGOAFFKASA-N
Inchi IDInChI=1S/C21H16N2OS/c1-23-19-10-6-5-9-17(19)20(16-7-3-2-4-8-16)22-18(21(23)24)13-15-11-12-25-14-15/h2-14H,1H3/b18-13+
PubChem CID15167795
ChEMBLCHEMBL20223
IUPHARN/A
BindingDB50019817
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
27142Cholecystokinin receptor type AQ63931CCKARCavia porcellus (Guinea pig)430
27143Gastrin/cholecystokinin type B receptorP32239CCKBRHomo sapiens (Human)447

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