| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 7th, 2007 | 33 | No |
| 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) | 3.38 | 11.31 | -75.46 | 1 | 9 | 0 | 120 | 473.913 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.38 | 8.78 | -52.06 | 0 | 9 | -1 | 119 | 472.905 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.83 | 11.56 | -58.12 | 2 | 9 | 1 | 117 | 474.921 | 8 | ↓ |
