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Ligand

NameCHEMBL410138
Molecular formulaC28H27N5O4
IUPAC name2-[2,4-dioxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)-5-phenyl-1,3,5-benzotriazepin-3-yl]-N-phenylacetamide
Molecular weight497.555
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP3.2
SynonymsSCHEMBL5434015
Inchi KeyFAUSTANOHBODCD-UHFFFAOYSA-N
Inchi IDInChI=1S/C28H27N5O4/c34-25(29-21-11-3-1-4-12-21)19-32-27(36)31(20-26(35)30-17-9-10-18-30)23-15-7-8-16-24(23)33(28(32)37)22-13-5-2-6-14-22/h1-8,11-16H,9-10,17-20H2,(H,29,34)
PubChem CID11248998
ChEMBLCHEMBL410138
IUPHARN/A
BindingDBN/A
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
73838Cholecystokinin receptor type AP32238CCKARHomo sapiens (Human)428
73839Gastrin/cholecystokinin type B receptorP32239CCKBRHomo sapiens (Human)447

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