UCSF

ZINC13282272

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 14th, 2008 26 Yes

Popular Name: 1,3-dimethyl-7-[2-[methyl-[(1S)-1-methyl-2-phenyl-ethyl]amino]ethyl]purine-2,6-dione 1,3-dimethyl-7-[2-[methyl-[(1S)-…

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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) 2.23 11.92 -51.75 1 7 1 66 356.45 6 ↓
Mid Mid (pH 6-8) 2.23 12.41 -118.57 2 7 2 68 357.458 6 ↓

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