UCSF

ZINC65498464

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 17th, 2011 23 No

Popular Name: 2-[[(3S,4S)-4-hydroxy-1,1-dioxo-thiolan-3-yl]-methyl-amino]-N-[(2-methoxyphenyl)methyl]acetamide 2-[[(3S,4S)-4-hydroxy-1,1-dioxo-…

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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) -0.04 -0.37 -54.87 3 7 1 97 343.425 6 ↓
Hi High (pH 8-9.5) -0.04 -2.31 -52.63 1 7 -1 99 341.409 6 ↓
Hi High (pH 8-9.5) -0.04 -2.83 -19.78 2 7 0 96 342.417 6 ↓
Hi High (pH 8-9.5) -0.04 0.14 -42.1 2 7 0 100 342.417 6 ↓

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Rings

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

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