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Ligand

NameCHEMBL1083292
Molecular formulaC18H22F3N5O2
IUPAC name1-(1-cyclopropylpropyl)-5-[[6-ethoxy-2-(trifluoromethyl)pyridin-3-yl]amino]-3-methyl-1,2,4-triazin-6-one
Molecular weight397.402
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP3.1
SynonymsBDBM50320255
1-(1-cyclopropylpropyl)-5-(6-ethoxy-2-(trifluoromethyl)pyridin-3-ylamino)-3-methyl-1,2,4-triazin-6(1H)-one
Inchi KeyDPUYEVBDLMNOER-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H22F3N5O2/c1-4-13(11-6-7-11)26-17(27)16(22-10(3)25-26)23-12-8-9-14(28-5-2)24-15(12)18(19,20)21/h8-9,11,13H,4-7H2,1-3H3,(H,22,23,25)
PubChem CID46891285
ChEMBLCHEMBL1083292
IUPHARN/A
BindingDB50320255
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
65965Corticotropin-releasing factor receptor 1P35353Crhr1Rattus norvegicus (Rat)415

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