| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 28th, 2008 | 21 | No |
Popular Name: 1-(2-hydroxyphenyl)-3-(4-nitrophenyl)propane-1,3-dione 1-(2-hydroxyphenyl)-3-(4-nitroph…
| 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) | 3.97 | 5.25 | -13.41 | 1 | 6 | 0 | 106 | 284.247 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.78 | 7.77 | -26.21 | 1 | 6 | 0 | 100 | 285.255 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.78 | 8.77 | -68.94 | 0 | 6 | -1 | 103 | 284.247 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.97 | 8.66 | -127.57 | 0 | 6 | -2 | 109 | 283.239 | 4 | ↓ |
