Bioactive Compound Details

BioIDbio2383
NameDIMENOXADOL
ChEMBL IDCHEMBL2104309
Molecular FormulaC20H25NO3
Molecular Weight327.42
Molecular Weight (Monoisotopic)327.1834
TypeSmall molecule
Max PhasePhase 2
Target IDTar12
Target NameToll-like receptor 9 (TLR9)
SynonymsACSCN-9617|DIMENOXADOL|DIMENOXADOLE|IDS-ND-011
SmilesCCOC(C(=O)OCCN(C)C)(c1ccccc1)c1ccccc1
InchiInChI=1S/C20H25NO3/c1-4-24-20(17-11-7-5-8-12-17,18-13-9-6-10-14-18)19(22)23-16-15-21(2)3/h5-14H,4,15-16H2,1-3H3
Inchi KeyRHUWRJWFHUKVED-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
Targets2.0
Bioactivities8.0
Np Likeness Score-0.35
Records Key['SID170466465', 'DIMENOXADOL', 'COVC-1751818611']
Records Name['SID170466465', 'DIMENOXADOL', 'DIMENOXADOL']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure