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Ligand

NameCHEMBL1086508
Molecular formulaC16H15Cl2F3N4O
IUPAC name1-(1-cyclopropylethyl)-5-[2,6-dichloro-4-(trifluoromethyl)anilino]-3-methyl-1,2,4-triazin-6-one
Molecular weight407.218
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP4.2
SynonymsBDBM50320231
1-(1-cyclopropylethyl)-5-(2,6-dichloro-4-(trifluoromethyl)phenylamino)-3-methyl-1,2,4-triazin-6(1H)-one
Inchi KeyALYLZBHAZKKANS-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H15Cl2F3N4O/c1-7(9-3-4-9)25-15(26)14(22-8(2)24-25)23-13-11(17)5-10(6-12(13)18)16(19,20)21/h5-7,9H,3-4H2,1-2H3,(H,22,23,24)
PubChem CID46891033
ChEMBLCHEMBL1086508
IUPHARN/A
BindingDB50320231
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
8669Corticotropin-releasing factor receptor 1P35353Crhr1Rattus norvegicus (Rat)415

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