UCSF

ZINC04736541

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 2nd, 2006 19 No

Popular Name: N-(5-Mercapto-4-methyl-4H-[1,2,4]triazol-3-ylmethyl)-2-methoxy-benzamide N-(5-Mercapto-4-methyl-4H-[1,2,4…

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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) 0.70 6.14 -16.57 2 6 0 72 278.337 4 ↓
Mid Mid (pH 6-8) 1.43 5.9 -46.83 1 6 -1 69 277.329 4 ↓

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

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