Bioactive Compound Details

BioIDbio1852
NameUPLARAFENIB
ChEMBL IDCHEMBL5314547
Molecular FormulaC22H21F3N4O4S
Molecular Weight494.5
Molecular Weight (Monoisotopic)494.1236
TypeSmall molecule
Max PhasePhase 2
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsUPLARAFENIB
SmilesCCCS(=O)(=O)Nc1cc(F)c(F)c(C(=O)c2ccc3ncc(N4CCOCC4)nc3c2)c1F
InchiInChI=1S/C22H21F3N4O4S/c1-2-9-34(31,32)28-17-11-14(23)20(24)19(21(17)25)22(30)13-3-4-15-16(10-13)27-18(12-26-15)29-5-7-33-8-6-29/h3-4,10-12,28H,2,5-9H2,1H3
Inchi KeyHAYBWDINAFTFCJ-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
TargetsNone
BioactivitiesNone
Np Likeness Score-1.79
Records Key['UPLARAFENIB']
Records Name['UPLARAFENIB']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure