| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 5th, 2006 | 12 | 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) | -0.83 | -0.67 | -6.28 | 2 | 4 | 0 | 58 | 208.308 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.83 | 0.41 | -87.59 | 2 | 4 | -2 | 58 | 206.292 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.83 | -0.13 | -42.61 | 2 | 4 | -1 | 58 | 207.3 | 5 | ↓ |
