Bioactive Compound Details

BioIDbio198127
NameNone
ChEMBL IDCHEMBL33241
Molecular FormulaC17H16O3
Molecular Weight268.31
Molecular Weight (Monoisotopic)268.1099
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
Synonyms2',6'-Dimethoxychalcone
SmilesCOc1cccc(OC)c1C(=O)/C=C/c1ccccc1
InchiInChI=1S/C17H16O3/c1-19-15-9-6-10-16(20-2)17(15)14(18)12-11-13-7-4-3-5-8-13/h3-12H,1-2H3/b12-11+
Inchi KeyGMODFQAQVHNPNU-VAWYXSNFSA-N
Molecular SpeciesNEUTRAL
Targets6.0
Bioactivities9.0
Np Likeness Score0.14
Records Key['42', '5', '1f', '1', '1f', '14, MAD-101']
Records Name['1-(2,6-Dimethoxy-phenyl)-3-phenyl-propenone', '1-(2,6-dimethoxyphenyl)-3-phenylprop-2-en-1-one', '(E)-1-(2,6-dimethoxyphenyl)-3-phenylprop-2-en-1-one', 2',6'-Dimethoxychalcone", '(E)-3-Phenyl-1-(2,6-dimethoxyphenyl)prop-2-en-1-one', '1-(2,6-dimethoxyphenyl)-3-phenylprop-2-en-1-one']"
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure