Bioactive Compound Details

BioIDbio199839
NameNone
ChEMBL IDCHEMBL523766
Molecular FormulaC15H15F3N4O4
Molecular Weight372.3
Molecular Weight (Monoisotopic)372.1045
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
Synonyms2-N-Me-824
SmilesCN1C[C@@H](OCc2ccc(OC(F)(F)F)cc2)Cn2cc([N+](=O)[O-])nc21
InchiInChI=1S/C15H15F3N4O4/c1-20-6-12(7-21-8-13(22(23)24)19-14(20)21)25-9-10-2-4-11(5-3-10)26-15(16,17)18/h2-5,8,12H,6-7,9H2,1H3/t12-/m1/s1
Inchi KeyPYHPGVYVMUDCJS-GFCCVEGCSA-N
Molecular SpeciesNEUTRAL
Targets2.0
Bioactivities3.0
Np Likeness Score-0.95
Records Key['12, 2-N-Me-824']
Records Name['1-((S)-2-(4-(Trifluoromethoxy)benzyloxy)-3-iodopropyl)-2-chloro-4-nitro-1H-imidazole']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure