Bioactive Compound Details

BioIDbio197407
Name2'-Deoxytubercidin
ChEMBL IDCHEMBL2074595
Molecular FormulaC11H14N4O3
Molecular Weight250.26
Molecular Weight (Monoisotopic)250.1066
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
Synonyms2'-Deoxytubercidin
SmilesNc1ncnc2c1ccn2[C@H]1C[C@H](O)[C@@H](CO)O1
InchiInChI=1S/C11H14N4O3/c12-10-6-1-2-15(11(6)14-5-13-10)9-3-7(17)8(4-16)18-9/h1-2,5,7-9,16-17H,3-4H2,(H2,12,13,14)/t7-,8+,9+/m0/s1
Inchi KeyNIJSNUNKSPLDTO-DJLDLDEBSA-N
Molecular SpeciesNEUTRAL
Targets18.0
Bioactivities29.0
Np Likeness Score0.9
Records Key['3a', 2'-Deoxytubercidin", "2'-Deoxytubercidin", '7']"
Records Name['5-(4-Amino-pyrrolo[2,3-d]pyrimidin-7-yl)-2-hydroxymethyl-tetrahydro-furan-3-ol', 2'-Deoxytubercidin", "2'-Deoxytubercidin", "5-(4-Amino-pyrrolo[2,3-d]pyrimidin-7-yl)-2-hydroxymethyl-tetrahydro-furan-3-ol (2'-deoxytubercidin)"]"
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure