UCSF

ZINC67076850

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 5th, 2011 22 No

Popular Name: 2-chloro-N-[2-(4-ethyl-5-sulfanyl-1,2,4-triazol-3-yl)ethyl]-4,5-difluoro-benzamide 2-chloro-N-[2-(4-ethyl-5-sulfany…

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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) 1.79 7.73 -21.64 2 5 0 63 346.79 5 ↓
Mid Mid (pH 6-8) 2.51 7.5 -51.4 1 5 -1 60 345.782 5 ↓

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

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