UCSF

ZINC53623997

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 24th, 2010 19 No

Popular Name: (3R)-N-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylethyl]-1,1-dioxo-thiolan-3-amine (3R)-N-[2-(4,6-dimethylpyrimidin…

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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) 1.45 2.97 -64.8 2 5 1 77 302.445 5 ↓
Mid Mid (pH 6-8) 1.45 1.79 -16.42 1 5 0 72 301.437 5 ↓

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

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