Bioactive Compound Details

BioIDbio3361
NameZIDESAMTINIB
ChEMBL IDCHEMBL5314497
Molecular FormulaC22H22FN7O
Molecular Weight419.46
Molecular Weight (Monoisotopic)419.187
TypeSmall molecule
Max PhasePhase 2
Target IDTar18
Target NameSerine/threonine-protein kinase cot (COT)
SynonymsZIDESAMTINIB
SmilesCCn1ncc2c1-c1cnc(N)c(c1)O[C@H](C)c1cc(F)ccc1-c1nn(C)nc1C2
InchiInChI=1S/C22H22FN7O/c1-4-30-21-13(11-26-30)7-18-20(28-29(3)27-18)16-6-5-15(23)9-17(16)12(2)31-19-8-14(21)10-25-22(19)24/h5-6,8-12H,4,7H2,1-3H3,(H2,24,25)/t12-/m1/s1
Inchi KeyDTWUUAFTYSMNQX-GFCCVEGCSA-N
Molecular SpeciesNEUTRAL
TargetsNone
BioactivitiesNone
Np Likeness Score-0.67
Records Key['ZIDESAMTINIB']
Records Name['ZIDESAMTINIB']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure