Bioactive Compound Details

BioIDbio3570
NameMIVAVOTINIB CITRATE
ChEMBL IDCHEMBL4594253
Molecular FormulaC23H29FN6O8
Molecular Weight536.52
Molecular Weight (Monoisotopic)344.1761
TypeSmall molecule
Max PhasePhase 2
Target IDTar18
Target NameSerine/threonine-protein kinase cot (COT)
SynonymsMIVAVOTINIB CITRATE|TAK 659|TAK-659
SmilesCn1cc(-c2nc(N[C@@H]3CCCC[C@@H]3N)c(F)c3c2C(=O)NC3)cn1.O=C(O)CC(O)(CC(=O)O)C(=O)O
InchiInChI=1S/C17H21FN6O.C6H8O7/c1-24-8-9(6-21-24)15-13-10(7-20-17(13)25)14(18)16(23-15)22-12-5-3-2-4-11(12)19;7-3(8)1-6(13,5(11)12)2-4(9)10/h6,8,11-12H,2-5,7,19H2,1H3,(H,20,25)(H,22,23);13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/t11-,12+;/m0./s1
Inchi KeyZVPYVZMKBQYKQG-ZVWHLABXSA-N
Molecular SpeciesBASE
TargetsNone
BioactivitiesNone
Np Likeness Score-0.78
Records Key['MIVAVOTINIB CITRATE', 'MIVAVOTINIB CITRATE']
Records Name['MIVAVOTINIB CITRATE', 'MIVAVOTINIB CITRATE']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure