Bioactive Compound Details

BioIDbio3495
NameMASITINIB MESYLATE
ChEMBL IDCHEMBL5315058
Molecular FormulaC29H34N6O4S2
Molecular Weight594.76
Molecular Weight (Monoisotopic)498.2202
TypeSmall molecule
Max PhaseUnknown
Target IDTar18
Target NameSerine/threonine-protein kinase cot (COT)
SynonymsMASITINIB MESILATE|MASITINIB METHANESULFONATE|Masivet
SmilesCS(=O)(=O)O.Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1Nc1nc(-c2cccnc2)cs1
InchiInChI=1S/C28H30N6OS.CH4O3S/c1-20-5-10-24(16-25(20)31-28-32-26(19-36-28)23-4-3-11-29-17-23)30-27(35)22-8-6-21(7-9-22)18-34-14-12-33(2)13-15-34;1-5(2,3)4/h3-11,16-17,19H,12-15,18H2,1-2H3,(H,30,35)(H,31,32);1H3,(H,2,3,4)
Inchi KeyTXCWBWKVIZGWEQ-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
TargetsNone
BioactivitiesNone
Np Likeness Score-2.11
Records Key['MASITINIB MESYLATE']
Records Name['MASITINIB MESYLATE']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure