| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 8th, 2010 | 30 | No |
Popular Name: [4-(2-hydroxy-5-nitro-benzoyl)piperazin-1-yl]-(2-hydroxy-5-nitro-phenyl)methanone [4-(2-hydroxy-5-nitro-benzoyl)pi…
| 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) | 2.21 | 5.04 | -46.65 | 1 | 12 | -1 | 176 | 415.338 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.21 | 6.39 | -84.56 | 0 | 12 | -2 | 178 | 414.33 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.21 | 4.71 | -19.62 | 2 | 12 | 0 | 173 | 416.346 | 4 | ↓ |
