Bioactive Compound Details

BioIDbio2600
NameGACYCLIDINE
ChEMBL IDCHEMBL3989791
Molecular FormulaC16H25NS
Molecular Weight263.45
Molecular Weight (Monoisotopic)263.1708
TypeSmall molecule
Max PhasePhase 2
Target IDTar12
Target NameToll-like receptor 9 (TLR9)
SynonymsGACICLIDINA|GACYCLIDINE|NST-001
SmilesCC1CCCCC1(c1cccs1)N1CCCCC1
InchiInChI=1S/C16H25NS/c1-14-8-3-4-10-16(14,15-9-7-13-18-15)17-11-5-2-6-12-17/h7,9,13-14H,2-6,8,10-12H2,1H3
Inchi KeyDKFAAPPUYWQKKF-UHFFFAOYSA-N
Molecular SpeciesBASE
TargetsNone
BioactivitiesNone
Np Likeness Score-0.31
Records Key['GACYCLIDINE', 'GACYCLIDINE']
Records Name['GACYCLIDINE', 'GACYCLIDINE']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure