| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 27th, 2010 | 24 | No |
Popular Name: (E)-3-(4-hydroxy-3-nitro-phenyl)-2-(2-methoxybenzoyl)prop-2-enenitrile (E)-3-(4-hydroxy-3-nitro-phenyl)…
| 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) | 3.21 | 7.44 | -12.48 | 1 | 7 | 0 | 116 | 324.292 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.21 | 8.46 | -44.83 | 0 | 7 | -1 | 119 | 323.284 | 5 | ↓ |
