Bioactive Compound Details

BioIDbio2991
NameSUNVOZERTINIB
ChEMBL IDCHEMBL5314564
Molecular FormulaC29H35ClFN7O3
Molecular Weight584.1
Molecular Weight (Monoisotopic)583.2474
TypeSmall molecule
Max PhasePhase 3
Target IDTar12
Target NameToll-like receptor 9 (TLR9)
Synonyms122507|A-1801|A1801|ASYM-122507|DZ'0586|DZ-0586|DZ00000586|DZ0586|DZD-9008|DZD9008|SUNVOZERTINIB
SmilesC=CC(=O)Nc1cc(Nc2nccc(Nc3cc(Cl)c(F)cc3C(C)(C)O)n2)c(OC)cc1N1CC[C@@H](N(C)C)C1
InchiInChI=1S/C29H35ClFN7O3/c1-7-27(39)34-22-14-23(25(41-6)15-24(22)38-11-9-17(16-38)37(4)5)35-28-32-10-8-26(36-28)33-21-13-19(30)20(31)12-18(21)29(2,3)40/h7-8,10,12-15,17,40H,1,9,11,16H2,2-6H3,(H,34,39)(H2,32,33,35,36)/t17-/m1/s1
Inchi KeyBTMKEDDEMKKSEF-QGZVFWFLSA-N
Molecular SpeciesBASE
Targets3.0
Bioactivities5.0
Np Likeness Score-1.24
Records Key['SUNVOZERTINIB', 'DZD9008', 'SUNVOZERTINIB']
Records Name['SUNVOZERTINIB', 'Sunvozertinib', 'SUNVOZERTINIB']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure