Bioactive Compound Details

BioIDbio197935
NameNone
ChEMBL IDCHEMBL490078
Molecular FormulaC15H13F3N4O5
Molecular Weight386.29
Molecular Weight (Monoisotopic)386.0838
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
Synonyms2-N-fjormyl-824
SmilesO=CN1C[C@@H](OCc2ccc(OC(F)(F)F)cc2)Cn2cc([N+](=O)[O-])nc21
InchiInChI=1S/C15H13F3N4O5/c16-15(17,18)27-11-3-1-10(2-4-11)8-26-12-5-20-7-13(22(24)25)19-14(20)21(6-12)9-23/h1-4,7,9,12H,5-6,8H2/t12-/m0/s1
Inchi KeyQALZWRJYHVQWAU-LBPRGKRZSA-N
Molecular SpeciesNEUTRAL
Targets2.0
Bioactivities6.0
Np Likeness Score-0.94
Records Key['8', '10, 2-N-fjormyl-824']
Records Name['(R)-2-nitro-6-(4-(trifluoromethoxy)benzyloxy)-6,7-dihydroimidazo[1,2-a]pyrimidine-8(5H)-carbaldehyde', '(R)-6-(4-(Trifluoromethoxy)benzyloxy)-6,7-dihydro-2-nitroimidazo[1,2-a]pyrimidine-8(5H)-carbaldehyde']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure