Bioactive Compound Details

BioIDbio198016
NameNone
ChEMBL IDCHEMBL253777
Molecular FormulaC16H14O4
Molecular Weight270.28
Molecular Weight (Monoisotopic)270.0892
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
Synonyms2'-Methoxy Liquiritigenin|2'-Methoxyisoliquiritigenin|2'-O-Methylisoliquiritigenin|3'-Deoxy-Sappanchalcone|3-Deoxysappanchalcone
SmilesCOc1cc(O)ccc1C(=O)/C=C/c1ccc(O)cc1
InchiInChI=1S/C16H14O4/c1-20-16-10-13(18)7-8-14(16)15(19)9-4-11-2-5-12(17)6-3-11/h2-10,17-18H,1H3/b9-4+
Inchi KeyPACBGANPVNHGNP-RUDMXATFSA-N
Molecular SpeciesNEUTRAL
Targets27.0
Bioactivities51.0
Np Likeness Score0.59
Records Key['26', '22', '15', '40', '6', '29', '2', '11', '13', '3', 'Figure 1, R1C1', '3', 'Fig 2, Cpd 4', '3-Deoxysappanchalcone']
Records Name[2,4'-dihydroxy-2'-methoxychalcone", "3'-deoxy-sappanchalcone", "4,4'-dihydroxy-2'-methoxychalcone", "4,4'-dihydroxy-2'-methoxychalcone", "2'-O-methylisoliquiritigenin", "4,4'-dihydroxy-2'-methoxychalcone", "2'-methoxy liquiritigenin", '3-deoxysappanchalcone', '3-deoxysappanchalcone', "2'-Methoxyisoliquiritigenin", '1-(4-hydroxy-2-methoxyphenyl)-3-(4-hydroxyphenyl)prop-2-en-1-one', '1-(4-hydroxy-2-methoxyphenyl)-3-(4-hydroxyphenyl)prop-2-en-1-one', '1-(4-hydroxy-2-methoxyphenyl)-3-(4-hydroxyphenyl)prop-2-en-1-one', '3-Deoxysappanchalcone']"
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure