UCSF

ZINC33754120

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 17th, 2009 25 No

Popular Name: [(2R,3S,4R,5R)-5-(2-amino-1-methyl-6-thioxo-purin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl [(2R,3S,4R,5R)-5-(2-amino-1-meth…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) -2.27 0.69 -152.59 4 12 -2 184 391.302 4 ↓
Mid Mid (pH 6-8) -2.27 -0.47 -62.45 5 12 -1 181 392.31 4 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID US5652359; WO1993007881A1 IBM Patent Data

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )