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Ligand

NameCHEMBL1086510
Molecular formulaC17H17Cl2F3N4O2
IUPAC name1-(1-cyclopropyl-2-methoxyethyl)-5-[2,6-dichloro-4-(trifluoromethyl)anilino]-3-methyl-1,2,4-triazin-6-one
Molecular weight437.244
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP3.7
SynonymsBDBM50320233
1-(1-cyclopropyl-2-methoxyethyl)-5-(2,6-dichloro-4-(trifluoromethyl)phenylamino)-3-methyl-1,2,4-triazin-6(1H)-one
Inchi KeyAOLKGXWFXWMNJO-UHFFFAOYSA-N
Inchi IDInChI=1S/C17H17Cl2F3N4O2/c1-8-23-15(16(27)26(25-8)13(7-28-2)9-3-4-9)24-14-11(18)5-10(6-12(14)19)17(20,21)22/h5-6,9,13H,3-4,7H2,1-2H3,(H,23,24,25)
PubChem CID46891035
ChEMBLCHEMBL1086510
IUPHARN/A
BindingDB50320233
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
10332Corticotropin-releasing factor receptor 1P35353Crhr1Rattus norvegicus (Rat)415

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