Bioactive Compound Details

BioIDbio198994
Name2'-O-DEMETHYLBIDWILLOL B
ChEMBL IDCHEMBL232935
Molecular FormulaC19H18O4
Molecular Weight310.35
Molecular Weight (Monoisotopic)310.1205
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
Synonyms2'-O-demethylbidwillol B
SmilesCC(C)=CCc1c(O)ccc(-c2cc3ccc(O)cc3o2)c1O
InchiInChI=1S/C19H18O4/c1-11(2)3-6-14-16(21)8-7-15(19(14)22)18-9-12-4-5-13(20)10-17(12)23-18/h3-5,7-10,20-22H,6H2,1-2H3
Inchi KeyJTWAOWXXBMXCGP-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
Targets7.0
Bioactivities16.0
Np Likeness Score1.73
Records Key['72', 1, 2'-O-demethylbidwillol B", '62', '51']"
Records Name[2'-O-Demethylbidwillol B", "2-[2',4'-dihydroxy-3'-(3-methylbut-2-enyl)phenyl]-6-hydroxybenzofuran", "2'-O-demethylbidwillol B", "2'-O-demethylbidwillol B"]"
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure