Bioactive Compound Details

BioIDbio3544
NameTRILACICLIB DIHYDROCHLORIDE
ChEMBL IDCHEMBL4650272
Molecular FormulaC24H32Cl2N8O
Molecular Weight519.48
Molecular Weight (Monoisotopic)446.2543
TypeSmall molecule
Max PhasePhase 4
Target IDTar18
Target NameSerine/threonine-protein kinase cot (COT)
SynonymsCOSELA|TRILACICLIB DIHYDROCHLORIDE
SmilesCN1CCN(c2ccc(Nc3ncc4cc5n(c4n3)C3(CCCCC3)CNC5=O)nc2)CC1.Cl.Cl
InchiInChI=1S/C24H30N8O.2ClH/c1-30-9-11-31(12-10-30)18-5-6-20(25-15-18)28-23-26-14-17-13-19-22(33)27-16-24(7-3-2-4-8-24)32(19)21(17)29-23;;/h5-6,13-15H,2-4,7-12,16H2,1H3,(H,27,33)(H,25,26,28,29);2*1H
Inchi KeyBRCYOXKEDFAUSA-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
TargetsNone
BioactivitiesNone
Np Likeness Score-0.89
Records Key['TRILACICLIB DIHYDROCHLORIDE']
Records Name['TRILACICLIB DIHYDROCHLORIDE']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure