UCSF

ZINC49237895

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 26th, 2010 20 Yes

Popular Name: 8-[[cyclopropylmethyl(methyl)amino]methyl]-3,7-dimethyl-purine-2,6-dione 8-[[cyclopropylmethyl(methyl)ami…

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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) -0.17 5.93 -51.53 2 7 1 77 278.336 4 ↓
Hi High (pH 8-9.5) -0.17 3.6 -9.1 1 7 0 76 277.328 4 ↓

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

No pre-computed analogs available. Try a structural similarity search.