Bioactive Compound Details

BioIDbio458
NamePOPULENE C
ChEMBL IDCHEMBL461300
Molecular FormulaC18H20O3
Molecular Weight284.36
Molecular Weight (Monoisotopic)284.1412
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsPopulene C
SmilesCC1=Cc2c(c(C)cc3c2C(C)COC3(C)C)C(=O)C1=O
InchiInChI=1S/C18H20O3/c1-9-7-13-14(11(3)8-21-18(13,4)5)12-6-10(2)16(19)17(20)15(9)12/h6-7,11H,8H2,1-5H3
Inchi KeyLKKQCDCZGYUJTA-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
Targets6.0
Bioactivities6.0
Np Likeness Score2.21
Records Key['3']
Records Name['Populene C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure