Bioactive Compound Details

BioIDbio972
NameDIDEMNIMIDE C TRIFLUOROACETATE SALT
ChEMBL IDCHEMBL1773916
Molecular FormulaC18H13F3N4O4
Molecular Weight406.32
Molecular Weight (Monoisotopic)292.096
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsDidemnimide C Trifluoroacetate Salt
SmilesCn1cncc1C1=C(c2c[nH]c3ccccc23)C(=O)NC1=O.O=C(O)C(F)(F)F
InchiInChI=1S/C16H12N4O2.C2HF3O2/c1-20-8-17-7-12(20)14-13(15(21)19-16(14)22)10-6-18-11-5-3-2-4-9(10)11;3-2(4,5)1(6)7/h2-8,18H,1H3,(H,19,21,22);(H,6,7)
Inchi KeyLSAUSLAQWZVZRI-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
Targets1.0
Bioactivities1.0
Np Likeness Score0.11
Records Key['Didemnimide C trifluoroacetate salt']
Records Name['Didemnimide C trifluoroacetate salt']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure