Bioactive Compound Details

BioIDbio198003
Name2-NITROANILINE
ChEMBL IDCHEMBL274009
Molecular FormulaC6H6N2O2
Molecular Weight138.13
Molecular Weight (Monoisotopic)138.0429
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
Synonyms2-Nitro-Phenylamine|2-Nitroaniline
SmilesNc1ccccc1[N+](=O)[O-]
InchiInChI=1S/C6H6N2O2/c7-5-3-1-2-4-6(5)8(9)10/h1-4H,7H2
Inchi KeyDPJCXCZTLWNFOH-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
Targets6.0
Bioactivities18.0
Np Likeness Score-1.32
Records Key['43', '2-Nitroaniline', '75', 'SID144209569', 'SID144213609', 'SID17388826', '67', 'Scheme 4, Cpd-3']
Records Name['2-Nitro-phenylamine', '2-Nitro-phenylamine', None, 'SID144209569', 'SID144213609', 'SID17388826', '2-nitroaniline', '2-nitroaniline']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure