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Ligand

Name(S)-2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)-N-(1-(4-(trifluoromethoxy)phenyl)propyl)acetamide
Molecular formulaC19H17F3N4O3
IUPAC name2-(4-oxo-1,2,3-benzotriazin-3-yl)-N-[(1S)-1-[4-(trifluoromethoxy)phenyl]propyl]acetamide
Molecular weight406.365
Hydrogen bond acceptor8
Hydrogen bond donor1
XlogP4.5
SynonymsLQEAGUMJDIWZGQ-HNNXBMFYSA-N
SCHEMBL17766961
BDBM263511
US9556130, test 86
Inchi KeyLQEAGUMJDIWZGQ-HNNXBMFYSA-N
Inchi IDInChI=1S/C19H17F3N4O3/c1-2-15(12-7-9-13(10-8-12)29-19(20,21)22)23-17(27)11-26-18(28)14-5-3-4-6-16(14)24-25-26/h3-10,15H,2,11H2,1H3,(H,23,27)/t15-/m0/s1
PubChem CID121349588
ChEMBLN/A
IUPHARN/A
BindingDB263511
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
563393Probable G-protein coupled receptor 139Q6DWJ6GPR139Homo sapiens (Human)353

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