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Ligand

NameCHEMBL473892
Molecular formulaC29H24F3N3O
IUPAC nameN-[2-(pyridin-2-ylmethylamino)-2,3-dihydro-1H-inden-5-yl]-2-[4-(trifluoromethyl)phenyl]benzamide
Molecular weight487.526
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP5.7
SynonymsBDBM50277221
rac-N-(2-(pyridin-2-ylmethylamino)-2,3-dihydro-1H-inden-5-yl)-4''-(trifluoromethyl)biphenyl-2-carboxamide
Inchi KeyFQVISFRAFHXJCA-UHFFFAOYSA-N
Inchi IDInChI=1S/C29H24F3N3O/c30-29(31,32)22-11-8-19(9-12-22)26-6-1-2-7-27(26)28(36)35-23-13-10-20-15-25(17-21(20)16-23)34-18-24-5-3-4-14-33-24/h1-14,16,25,34H,15,17-18H2,(H,35,36)
PubChem CID44591290
ChEMBLCHEMBL473892
IUPHARN/A
BindingDB50277221
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
85114Smoothened homologP56726SmoMus musculus (Mouse)793
85115Smoothened homologQ99835SMOHomo sapiens (Human)787

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