Bioactive Compound Details

BioIDbio706
NameTHENIUM CLOSYLATE
ChEMBL IDCHEMBL2107164
Molecular FormulaC21H24ClNO4S2
Molecular Weight454.01
Molecular Weight (Monoisotopic)262.126
TypeSmall molecule
Max PhasePhase 2
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
Synonyms611 C 65|611-C-65|CLOSILATE DE THENIUM|CLOSILATO DE TENIO|NSC-106569|THENIUM CLOSILATE|THENIUM CLOSYLATE
SmilesC[N+](C)(CCOc1ccccc1)Cc1cccs1.O=S(=O)([O-])c1ccc(Cl)cc1
InchiInChI=1S/C15H20NOS.C6H5ClO3S/c1-16(2,13-15-9-6-12-18-15)10-11-17-14-7-4-3-5-8-14;7-5-1-3-6(4-2-5)11(8,9)10/h3-9,12H,10-11,13H2,1-2H3;1-4H,(H,8,9,10)/q+1;/p-1
Inchi KeyQMAHSUSUOMSSBK-UHFFFAOYSA-M
Molecular SpeciesNEUTRAL
TargetsNone
BioactivitiesNone
Np Likeness Score-1.12
Records Key['THENIUM CLOSYLATE']
Records Name['THENIUM CLOSYLATE']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure