Bioactive Compound Details

BioIDbio198086
NameBROMINDIONE
ChEMBL IDCHEMBL288496
Molecular FormulaC15H9BrO2
Molecular Weight301.14
Molecular Weight (Monoisotopic)299.9786
TypeSmall molecule
Max PhasePhase 2
Target IDTar81
Target NameNone
Synonyms2-(P-BROMOPHENYL)-1,3-INDANDIONE|BROMINDIONA|BROMINDIONE|Bromindione|NSC-759118
SmilesO=C1c2ccccc2C(=O)C1c1ccc(Br)cc1
InchiInChI=1S/C15H9BrO2/c16-10-7-5-9(6-8-10)13-14(17)11-3-1-2-4-12(11)15(13)18/h1-8,13H
Inchi KeyNPUZIGSOEWMFKK-UHFFFAOYSA-N
Molecular SpeciesACID
Targets21.0
Bioactivities43.0
Np Likeness Score-0.22
Records Key['17', 'SID144205472', 'SID49670215', 'SID170466392', 'BROMINDIONE', 'SID29216274', 'BROMINDIONE', 'BROMINDIONE', 'BROMINDIONE', 'BROMINDIONE', 'COVC-3362738687']
Records Name['2-(4-Bromo-phenyl)-indan-1,3-dione', 'SID144205472', 'SID49670215', 'SID170466392', 'BROMINDIONE', 'SID29216274', 'BROMINDIONE', 'BROMINDIONE', 'BROMINDIONE', 'BROMINDIONE', 'BROMINDIONE']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure