Bioactive Compound Details

BioIDbio583
NameNone
ChEMBL IDCHEMBL259633
Molecular FormulaC16H14N2O2S
Molecular Weight298.37
Molecular Weight (Monoisotopic)298.0776
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsC-5950331
SmilesO=c1[nH]c(-c2cccc(O)c2)nc2sc3c(c12)CCCC3
InchiInChI=1S/C16H14N2O2S/c19-10-5-3-4-9(8-10)14-17-15(20)13-11-6-1-2-7-12(11)21-16(13)18-14/h3-5,8,19H,1-2,6-7H2,(H,17,18,20)
Inchi KeyYEBWEMIJOWUBEM-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
Targets6.0
Bioactivities15.0
Np Likeness Score-1.45
Records Key['2, C-5950331']
Records Name['2-(3-Hydroxy-phenyl)-5,6,7,8-tetrahydro-3H-benzo[4,5]thieno[2,3-d]pyrimidin-4-one']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure