Bioactive Compound Details

BioIDbio199643
NameNone
ChEMBL IDCHEMBL454802
Molecular FormulaC7H9N5O
Molecular Weight179.18
Molecular Weight (Monoisotopic)179.0807
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
SynonymsN6-(2-Hydroxy)Ethyladenine
SmilesOCCNc1ncnc2[nH]cnc12
InchiInChI=1S/C7H9N5O/c13-2-1-8-6-5-7(10-3-9-5)12-4-11-6/h3-4,13H,1-2H2,(H2,8,9,10,11,12)
Inchi KeyQFSMBOBIZVSDLV-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
Targets65.0
Bioactivities72.0
Np Likeness Score-0.71
Records Key['SID540144', '20', 'Table S1, R30C1', 'SID4252569', '20']
Records Name['SID540144', 'N6-(2-hydroxy)ethyladenine', '2-(9H-purin-6-ylamino)ethanol', 'SID4252569', '6-(2-Hydroxyethyl)amino-9H-purine']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure