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Ligand

NameCHEMBL550216
Molecular formulaC17H15Cl3F3N3O2
IUPAC name5-chloro-1-[(1R)-1-cyclopropyl-2-methoxyethyl]-3-[2,6-dichloro-4-(trifluoromethyl)anilino]pyrazin-2-one
Molecular weight456.671
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP4.5
Synonyms(R)-5-Chloro-1-(1-cyclopropyl-2-methoxyethyl)-3-[2,6-dichloro-4-(trifluoromethyl)phenylamino]pyrazin-2(1H)-one
BDBM50293925
Inchi KeyDYIVSGDVNIYLSL-LBPRGKRZSA-N
Inchi IDInChI=1S/C17H15Cl3F3N3O2/c1-28-7-12(8-2-3-8)26-6-13(20)24-15(16(26)27)25-14-10(18)4-9(5-11(14)19)17(21,22)23/h4-6,8,12H,2-3,7H2,1H3,(H,24,25)/t12-/m0/s1
PubChem CID44191010
ChEMBLCHEMBL550216
IUPHARN/A
BindingDB50293925
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
72013Corticotropin-releasing factor receptor 1P35353Crhr1Rattus norvegicus (Rat)415

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