Bioactive Compound Details

BioIDbio200567
NameTAS-106
ChEMBL IDCHEMBL573352
Molecular FormulaC11H13N3O5
Molecular Weight267.24
Molecular Weight (Monoisotopic)267.0855
TypeSmall molecule
Max PhasePhase 2
Target IDTar81
Target NameNone
Synonyms2'-C-Ethynylcytidine|3'-C-Ethynylcytidine|TAS 106|TAS-106
SmilesC#C[C@@]1(O)[C@@H](CO)O[C@@H](n2ccc(N)nc2=O)[C@@H]1O
InchiInChI=1S/C11H13N3O5/c1-2-11(18)6(5-15)19-9(8(11)16)14-4-3-7(12)13-10(14)17/h1,3-4,6,8-9,15-16,18H,5H2,(H2,12,13,17)/t6-,8+,9-,11-/m1/s1
Inchi KeyJFIWEPHGRUDAJN-DYUFWOLASA-N
Molecular SpeciesNEUTRAL
Targets75.0
Bioactivities138.0
Np Likeness Score1.37
Records Key['NM 176', 'ECyd', 'NM 176', 'TAS-106', 'COVC-3372218620']
Records Name[2'-C-ethynylcytidine", "3'-C-ethynylcytidine", "2'-C-ethynylcytidine", 'TAS-106', 'ETHYNYLCYTIDINE']"
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure