UCSF

ZINC53344223

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 20th, 2010 19 No

Popular Name: N'-[(3R)-1,1-dioxothiolan-3-yl]-N-methyl-N-(1-methyl-4-piperidyl)ethane-1,2-diamine N'-[(3R)-1,1-dioxothiolan-3-yl]-…

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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) 0.07 0.75 -44.07 2 5 1 54 290.453 5 ↓
Mid Mid (pH 6-8) 0.07 1.92 -110.45 3 5 2 58 291.461 5 ↓

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

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