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Ligand

NameCHEMBL1907839
Molecular formulaC23H18IN3O2
IUPAC name2-iodo-N-[(3S)-1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]benzamide
Molecular weight495.32
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP4.4
SynonymsBDBM50367632
N-[[(3S)-1-Methyl-2-oxo-5-phenyl-2,3-dihydro-1H-1,4-benzodiazepin]-3-yl]-2-iodobenzamide
SCHEMBL9865574
AXVHDVOFVUKUNK-OAQYLSRUSA-N
(S)-N-(2,3-Dihydro-1-methyl-2-oxo-5-phenyl-1H-1,4-benzodiazepin-3-yl)-2-iodobenzamide
Inchi KeyAXVHDVOFVUKUNK-OAQYLSRUSA-N
Inchi IDInChI=1S/C23H18IN3O2/c1-27-19-14-8-6-12-17(19)20(15-9-3-2-4-10-15)25-21(23(27)29)26-22(28)16-11-5-7-13-18(16)24/h2-14,21H,1H3,(H,26,28)/t21-/m1/s1
PubChem CID14208315
ChEMBLCHEMBL1907839
IUPHARN/A
BindingDB50367632
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
17110Cholecystokinin receptor type AP30551CckarRattus norvegicus (Rat)444
17109Gastrin/cholecystokinin type B receptorP32239CCKBRHomo sapiens (Human)447

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