UCSF

ZINC05779997

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 13th, 2006 24 No

Popular Name: N-(2-cyanoethyl)-N-(3,5-dimethylphenyl)-2-[(1-oxido-2-pyridyl)sulfanyl]acetamide N-(2-cyanoethyl)-N-(3,5-dimethyl…

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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) 1.55 2.87 -36.04 0 5 0 69 341.436 6 ↓

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Rings

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

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