UCSF

ZINC69571332

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2011 25 No

Popular Name: 2-[(2S)-2-(1,3-dioxolan-2-yl)-1-piperidyl]-N-(4-methyl-3-nitro-phenyl)acetamide 2-[(2S)-2-(1,3-dioxolan-2-yl)-1-…

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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) 2.55 7.62 -42.39 2 8 1 98 350.395 5 ↓
Hi High (pH 8-9.5) 2.55 5.66 -10.88 1 8 0 97 349.387 5 ↓

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

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