UCSF

ZINC57279124

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 18th, 2011 21 Yes

Popular Name: 8,9-dimethyl-N6-[2-(2-pyridyl)ethyl]purine-2,6-diamine 8,9-dimethyl-N6-[2-(2-pyridyl)et…

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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) 1.20 6.77 -13.75 3 7 0 95 283.339 4 ↓
Lo Low (pH 4.5-6) 1.20 7.53 -84.31 5 7 2 97 285.355 4 ↓
Lo Low (pH 4.5-6) 1.20 7.12 -39.54 4 7 1 96 284.347 4 ↓

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

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