UCSF

ZINC68960122

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 16th, 2011 25 No

Popular Name: N-(3-methoxypropyl)-2-[methyl-[[4-(o-tolyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]amino]acetamide N-(3-methoxypropyl)-2-[methyl-[[…

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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) 1.28 10.88 -46.08 2 7 1 66 364.495 9 ↓
Mid Mid (pH 6-8) 1.28 8.44 -18.71 1 7 0 64 363.487 9 ↓

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

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