UCSF

ZINC37718259

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 29th, 2009 16 No

Popular Name: (3S)-1,1-dioxo-N-[2-(3-pyridyl)ethyl]thiolan-3-amine (3S)-1,1-dioxo-N-[2-(3-pyridyl)e…

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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) 0.19 2.05 -66.56 2 4 1 64 241.336 4 ↓
Hi High (pH 8-9.5) 0.19 0.9 -14.03 1 4 0 59 240.328 4 ↓

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

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