Bioactive Compound Details

BioIDbio198305
NameNone
ChEMBL IDCHEMBL1224659
Molecular FormulaC7H7N5O2
Molecular Weight193.17
Molecular Weight (Monoisotopic)193.06
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
SynonymsN-2-Acetylguanine
SmilesCC(=O)Nc1nc(=O)c2[nH]cnc2[nH]1
InchiInChI=1S/C7H7N5O2/c1-3(13)10-7-11-5-4(6(14)12-7)8-2-9-5/h2H,1H3,(H3,8,9,10,11,12,13,14)
Inchi KeyMXSMRDDXWJSGMC-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
Targets4.0
Bioactivities5.0
Np Likeness Score-0.77
Records Key['N-2-Acetylguanine', 'G4', '17a']
Records Name['N-2-Acetylguanine', 'N-(6-oxo-6,9-dihydro-1H-purin-2-yl)acetamide', 'N-(6-oxo-6,9-dihydro-1H-purin-2-yl)acetamide']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure