Bioactive Compound Details

BioIDbio114432
NameGAMCEMETINIB
ChEMBL IDCHEMBL5314585
Molecular FormulaC22H20ClN5O3S
Molecular Weight469.95
Molecular Weight (Monoisotopic)469.0975
TypeSmall molecule
Max PhasePhase 2
Target IDTar98
Target NameNone
SynonymsBMS-986371|CC-99677|GAMCEMETINIB
SmilesCCOCc1cnc(Cl)nc1Oc1ccc2c(ccc3sc4c(c32)NC[C@@H](C)NC4=O)n1
InchiInChI=1S/C22H20ClN5O3S/c1-3-30-10-12-9-25-22(23)28-21(12)31-16-7-4-13-14(27-16)5-6-15-17(13)18-19(32-15)20(29)26-11(2)8-24-18/h4-7,9,11,24H,3,8,10H2,1-2H3,(H,26,29)/t11-/m1/s1
Inchi KeyPYOQIOLRFIRRSO-LLVKDONJSA-N
Molecular SpeciesNEUTRAL
TargetsNone
BioactivitiesNone
Np Likeness Score-0.65
Records Key['GAMCEMETINIB', 'GAMCEMETINIB', 'GAMCEMETINIB']
Records Name['GAMCEMETINIB', 'GAMCEMETINIB', 'GAMCEMETINIB']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure