Bioactive Compound Details

BioIDbio738
NameFLAVOKAWAIN C
ChEMBL IDCHEMBL251958
Molecular FormulaC17H16O5
Molecular Weight300.31
Molecular Weight (Monoisotopic)300.0998
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsFlavokawain C
SmilesCOc1cc(O)c(C(=O)/C=C/c2ccc(O)cc2)c(OC)c1
InchiInChI=1S/C17H16O5/c1-21-13-9-15(20)17(16(10-13)22-2)14(19)8-5-11-3-6-12(18)7-4-11/h3-10,18,20H,1-2H3/b8-5+
Inchi KeyUXUFMIJZNYXWDX-VMPITWQZSA-N
Molecular SpeciesNEUTRAL
Targets10.0
Bioactivities15.0
Np Likeness Score0.78
Records Key['Flavokawain C', '8', '5, flavokawin', '1d', '2c', '7', '30', 'Flavokawain C', 'FK C']
Records Name['Flavokawain C', 'flavokawain C', '2,4-Dihydroxy-4,6-dimethoxychalcone', 'Flavokawain C', '1-(2-hydroxy-4,6-dimethoxyphenyl)-3-(4-hydroxyphenyl)prop-2-en-1-one', 2',4'-dihydroxy-4,6'-dimethoxychalcone", "2',4-Dihydroxy-4',6'-dimethoxychalcone", 'Flavokawain C', "(E)-1-(2'-hydroxy-4',6'-dimethoxyphenyl)-3-(4-hydroxyphenyl)prop-2-en-1-one"]"
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure