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Ligand

NameCHEMBL3115392
Molecular formulaC25H24F3N3O
IUPAC name2-(4-tert-butylphenyl)-1-[2-(trifluoromethyl)-5,11-dihydropyrido[3,2-c][1,5]benzodiazepin-6-yl]ethanone
Molecular weight439.482
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP5.8
SynonymsBDBM50447504
Inchi KeyGECLYQBQJLSAFB-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H24F3N3O/c1-24(2,3)18-11-8-16(9-12-18)14-22(32)31-15-17-10-13-21(25(26,27)28)30-23(17)29-19-6-4-5-7-20(19)31/h4-13H,14-15H2,1-3H3,(H,29,30)
PubChem CID76317822
ChEMBLCHEMBL3115392
IUPHARN/A
BindingDB50447504
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
94207Bombesin receptor subtype-3P32247BRS3Homo sapiens (Human)399
94208Bombesin receptor subtype-3O54798Brs3Mus musculus (Mouse)399

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