Bioactive Compound Details

BioIDbio1276
NamePOCHONIN C
ChEMBL IDCHEMBL459482
Molecular FormulaC18H18Cl2O6
Molecular Weight401.24
Molecular Weight (Monoisotopic)400.048
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsPochonin C
SmilesC[C@H]1C[C@H](O)C(Cl)/C=C\C=C\C(=O)Cc2c(Cl)c(O)cc(O)c2C(=O)O1
InchiInChI=1S/C18H18Cl2O6/c1-9-6-13(22)12(19)5-3-2-4-10(21)7-11-16(18(25)26-9)14(23)8-15(24)17(11)20/h2-5,8-9,12-13,22-24H,6-7H2,1H3/b4-2+,5-3-/t9-,12?,13-/m0/s1
Inchi KeyMQEXBOUTQRMRFJ-NOEJZYACSA-N
Molecular SpeciesNEUTRAL
Targets6.0
Bioactivities7.0
Np Likeness Score2.26
Records Key['6', '3']
Records Name['pochonin C', 'Pochonin C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure