Bioactive Compound Details

BioIDbio2742
NameOSAVAMPATOR
ChEMBL IDCHEMBL4594403
Molecular FormulaC19H23N3O3S
Molecular Weight373.48
Molecular Weight (Monoisotopic)373.146
TypeSmall molecule
Max PhasePhase 2
Target IDTar12
Target NameToll-like receptor 9 (TLR9)
SynonymsOSAVAMPATOR|TAK-653
SmilesCC1=CN2CCS(=O)(=O)N=C2C(c2ccc(OC3CCCCC3)cc2)=N1
InchiInChI=1S/C19H23N3O3S/c1-14-13-22-11-12-26(23,24)21-19(22)18(20-14)15-7-9-17(10-8-15)25-16-5-3-2-4-6-16/h7-10,13,16H,2-6,11-12H2,1H3
Inchi KeyPXJBHEHFVQVDDS-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
TargetsNone
BioactivitiesNone
Np Likeness Score-0.67
Records Key['OSAVAMPATOR', 'OSAVAMPATOR']
Records Name['OSAVAMPATOR', 'OSAVAMPATOR']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure