Bioactive Compound Details

BioIDbio200288
NameNone
ChEMBL IDCHEMBL2347439
Molecular FormulaC17H27ClN4O
Molecular Weight338.88
Molecular Weight (Monoisotopic)338.1873
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
Synonyms2-Chloro-6-(dodecyloxy)purine
SmilesCCCCCCCCCCCCOc1nc(Cl)nc2[nH]cnc12
InchiInChI=1S/C17H27ClN4O/c1-2-3-4-5-6-7-8-9-10-11-12-23-16-14-15(20-13-19-14)21-17(18)22-16/h13H,2-12H2,1H3,(H,19,20,21,22)
Inchi KeyGTUPWYULIIFSLW-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
Targets3.0
Bioactivities5.0
Np Likeness Score-0.42
Records Key['27']
Records Name['2-Chloro-6-(dodecyloxy)purine']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure