| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 25th, 2011 | 19 | No |
Popular Name: 2-Hydroxy-N-((1S,2S,6S)-2-hydroxy-5-oxo-7-oxabicyclo[4.1.0]hept-3-en-3-yl)benzamide 2-Hydroxy-N-((1S,2S,6S)-2-hydrox…
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CAS Number: 287194-40-5
| 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) | 1.78 | -2.18 | -16.44 | 4 | 6 | 0 | 102 | 261.233 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.78 | -1.85 | -51.3 | 3 | 6 | -1 | 105 | 260.225 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.78 | -1.17 | -59.94 | 3 | 6 | -1 | 105 | 260.225 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.