UCSF

ZINC61325513

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 8th, 2011 22 No

Popular Name: N-(1,1-dimethylpropyl)-2-(1,1,4-trioxo-2H-benzo[e]thiadiazin-3-yl)acetamide N-(1,1-dimethylpropyl)-2-(1,1,4-…

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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) 1.53 1.27 -16.89 2 7 0 96 325.39 4 ↓
Hi High (pH 8-9.5) 1.53 1.57 -52.49 1 7 -1 98 324.382 4 ↓

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

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