Bioactive Compound Details

BioIDbio197769
NameNone
ChEMBL IDCHEMBL363682
Molecular FormulaC18H15BrO2
Molecular Weight343.22
Molecular Weight (Monoisotopic)342.0255
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
Synonyms2-Bromo-Benzylidene Tetralone
SmilesCOc1ccc2c(c1)CC/C(=C\c1ccccc1Br)C2=O
InchiInChI=1S/C18H15BrO2/c1-21-15-8-9-16-12(11-15)6-7-14(18(16)20)10-13-4-2-3-5-17(13)19/h2-5,8-11H,6-7H2,1H3/b14-10+
Inchi KeyZHOQTMYSBFYMPC-GXDHUFHOSA-N
Molecular SpeciesNEUTRAL
Targets5.0
Bioactivities5.0
Np Likeness Score-0.42
Records Key['2d', '2c', '7']
Records Name['2-[1-(2-Bromo-phenyl)-meth-(E)-ylidene]-6-methoxy-3,4-dihydro-2H-naphthalen-1-one', '2-[1-(2-bromophenyl)methylidene]-6-methoxy-3,4-dihydro-2H-naphthalen-1-one', '2-bromo-benzylidene tetralone']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure