| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2010 | 25 | No |
Popular Name: 4-Nitrobenzyl 6-(1-hydroxyethyl)-3,7-dioxo-1-azabicyclo[3.2.0]heptane-2-carboxylate 4-Nitrobenzyl 6-(1-hydroxyethyl)…
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CAS Numbers: 74288-40-7 , 77449-43-5 , [77449-43-5]
(5R,6S)-4-Nitrobenzyl 6-((R)-1-hydroxyethyl)-3,7-dioxo-1-azabicyclo[3.2.0]heptane-2-carboxylate
4-Nitrobenzyl6-(1-hydroxyethyl)-3,7-dioxo-1-azabicyclo[3.2.0]heptane-2-carboxylate
| 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) | 0.32 | 3.97 | -19.18 | 1 | 9 | 0 | 130 | 348.311 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.46 | 3.73 | -45.06 | 1 | 9 | -1 | 136 | 347.303 | 6 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
![1-azabicyclo[3.2.0]heptane-3,7-quinone](http://zinc12.docking.org/img/rings/195004.gif)
![3,7-diketo-1-azabicyclo[3.2.0]heptane-2-carboxylic Acid Benzyl Ester](http://zinc12.docking.org/img/rings/375606.gif)
