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Ligand

NameCHEMBL66572
Molecular formulaC17H13F3N4O
IUPAC nameN'-(3-cyanophenyl)-2-oxo-N-[2-(trifluoromethyl)anilino]propanimidamide
Molecular weight346.313
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogP4.3
SynonymsBDBM50113207
(1E)-N-(3-cyanophenyl)-2-oxo-N''-[2-(trifluoromethyl)phenyl]propanehydrazonamide
Inchi KeyAUOMSSDGYHGQLX-UHFFFAOYSA-N
Inchi IDInChI=1S/C17H13F3N4O/c1-11(25)16(22-13-6-4-5-12(9-13)10-21)24-23-15-8-3-2-7-14(15)17(18,19)20/h2-9,23H,1H3,(H,22,24)
PubChem CID11121533
ChEMBLCHEMBL66572
IUPHARN/A
BindingDB50113207
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: 1
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GLASS IDNameUniProtGeneSpeciesLength
14838Corticotropin-releasing factor receptor 1P34998CRHR1Homo sapiens (Human)444

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