| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 21st, 2008 | 26 | No |
Popular Name: 3-{4-hydroxy-3-nitro-5-methoxyphenyl}-2-(6-methyl-1H-benzimidazol-2-yl)acrylonitrile 3-{4-hydroxy-3-nitro-5-methoxyph…
| 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) | 3.26 | 7.61 | -16.45 | 2 | 8 | 0 | 128 | 350.334 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.26 | 8.26 | -96.91 | 0 | 8 | -2 | 129 | 348.318 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.26 | 8.26 | -97.49 | 0 | 8 | -2 | 129 | 348.318 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.26 | 8.68 | -52.03 | 1 | 8 | -1 | 131 | 349.326 | 4 | ↓ |
