UCSF

ZINC49316228

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 26th, 2010 20 No

Popular Name: N-[2-[[(3S)-1,1-dioxothiolan-3-yl]amino]-2-oxo-ethyl]-N-methyl-1H-triazole-4-carboxamide N-[2-[[(3S)-1,1-dioxothiolan-3-y…

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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) -1.41 -2.14 -21.78 2 9 0 125 301.328 4 ↓
Mid Mid (pH 6-8) -1.41 -2.16 -51.37 1 9 -1 123 300.32 4 ↓

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

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