Bioactive Compound Details

BioIDbio2413
NamePIBOSEROD HYDROCHLORIDE
ChEMBL IDCHEMBL2106927
Molecular FormulaC22H32ClN3O2
Molecular Weight405.97
Molecular Weight (Monoisotopic)369.2416
TypeSmall molecule
Max PhaseUnknown
Target IDTar12
Target NameToll-like receptor 9 (TLR9)
SynonymsPIBOSEROD HCL|PIBOSEROD HYDROCHLORIDE|SB-207266-A
SmilesCCCCN1CCC(CNC(=O)c2c3n(c4ccccc24)CCCO3)CC1.Cl
InchiInChI=1S/C22H31N3O2.ClH/c1-2-3-11-24-13-9-17(10-14-24)16-23-21(26)20-18-7-4-5-8-19(18)25-12-6-15-27-22(20)25;/h4-5,7-8,17H,2-3,6,9-16H2,1H3,(H,23,26);1H
Inchi KeyUABVCZHWRUGYSR-UHFFFAOYSA-N
Molecular SpeciesBASE
TargetsNone
BioactivitiesNone
Np Likeness Score-0.97
Records Key['PIBOSEROD HYDROCHLORIDE']
Records Name['PIBOSEROD HYDROCHLORIDE']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure