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Ligand

NameCHEMBL596509
Molecular formulaC21H12F4N2O3
IUPAC name1-[[4-(6-fluoropyridin-3-yl)phenyl]methyl]-5-(trifluoromethoxy)indole-2,3-dione
Molecular weight416.332
Hydrogen bond acceptor8
Hydrogen bond donor0
XlogP4.6
Synonyms1-(4-(6-fluoropyridin-3-yl)benzyl)-5-(trifluoromethoxy)indoline-2,3-dione
CHEBI:92780
VU0365121-1
BDBM50305821
Inchi KeyAWIDPYRUVXANEO-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H12F4N2O3/c22-18-8-5-14(10-26-18)13-3-1-12(2-4-13)11-27-17-7-6-15(30-21(23,24)25)9-16(17)19(28)20(27)29/h1-10H,11H2
PubChem CID45281801
ChEMBLCHEMBL596509
IUPHARN/A
BindingDB50305821
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
16048Muscarinic acetylcholine receptor M1P08482Chrm1Rattus norvegicus (Rat)460
16049Muscarinic acetylcholine receptor M5P08912CHRM5Homo sapiens (Human)532

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