UCSF

ZINC22057942

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 12th, 2008 22 Yes

Popular Name: 9-[(2R,3S,4R,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-2-dimethylamino-1H-purin-6-one 9-[(2R,3S,4R,5R)-3,4-dihydroxy-5…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

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) -0.86 -1.42 -27.75 4 10 0 137 311.298 3 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0238672A1; EP0311694A1; EP0311694B1; EP0728520A1; US4665018; US4900407; US4929544; US5144018; US5476931; WO1993014465A1; WO2000008140A2; WO2000008141A2; WO2000027340A2; WO2000056762A2 IBM Patent Data

Activity (Go SEA)

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