Bioactive Compound Details

BioIDbio197205
Name2'-BETA-FLUORO-2',3'-DEOXYADENOSINE
ChEMBL IDCHEMBL309579
Molecular FormulaC10H12FN5O3
Molecular Weight269.24
Molecular Weight (Monoisotopic)269.0924
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
SynonymsNone
SmilesNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1F
InchiInChI=1S/C10H12FN5O3/c11-5-7(18)4(1-17)19-10(5)16-3-15-6-8(12)13-2-14-9(6)16/h2-5,7,10,17-18H,1H2,(H2,12,13,14)/t4-,5-,7-,10-/m1/s1
Inchi KeyZGYYPTJWJBEXBC-QYYRPYCUSA-N
Molecular SpeciesNEUTRAL
Targets12.0
Bioactivities413.0
Np Likeness Score0.89
Records Key['5', '10', '7', '3', 2'd2'FA", "1, 2'-alpha-F dA", "2'-BETA-FLUORO-2',3'-DEOXYADENOSINE"]"
Records Name['5-(6-amino-9H-purin-9-yl)-4-fluoro-2-(hydroxymethyl)oxolan-3-ol', '5-(6-Amino-purin-9-yl)-4-fluoro-2-hydroxymethyl-tetrahydro-furan-3-ol', '(2R,3R,4R,5R)-4-Fluoro-2-hydroxymethyl-5-(6-methylamino-purin-9-yl)-tetrahydro-furan-3-ol', 2'-deoxy-2'-fluoroadenosine", '(2R,3R,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-fluoro-2-(hydroxymethyl)tetrahydrofuran-3-ol', '(2R,3R,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-fluoro-2-(hydroxymethyl)tetrahydrofuran-3-ol', "2'-BETA-FLUORO-2',3'-DEOXYADENOSINE"]"
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure