Bioactive Compound Details

BioIDbio43
NameCHETOSEMINUDIN C
ChEMBL IDCHEMBL470548
Molecular FormulaC16H19N3O3S2
Molecular Weight365.48
Molecular Weight (Monoisotopic)365.0868
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsChetoseminudin C|Chetoseminudin-C
SmilesCS[C@]1(CO)NC(=O)[C@](Cc2c[nH]c3ccccc23)(SC)NC1=O
InchiInChI=1S/C16H19N3O3S2/c1-23-15(7-10-8-17-12-6-4-3-5-11(10)12)13(21)19-16(9-20,24-2)14(22)18-15/h3-6,8,17,20H,7,9H2,1-2H3,(H,18,22)(H,19,21)/t15-,16-/m0/s1
Inchi KeyNOPTYKZKJYUDRQ-HOTGVXAUSA-N
Molecular SpeciesNEUTRAL
Targets12.0
Bioactivities14.0
Np Likeness Score0.97
Records Key['4, CS-D', '9', '7', '11']
Records Name['chetoseminudin C', 'chetoseminudin C', 'Chetoseminudin-C', 'Chetoseminudin C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure