| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 12th, 2009 | 36 | 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) | 4.27 | 12.96 | -68.28 | 1 | 7 | 0 | 87 | 488.584 | 11 | ↓ |
| Hi High (pH 8-9.5) | 4.27 | 10.63 | -60.12 | 0 | 7 | -1 | 86 | 487.576 | 11 | ↓ |
| Lo Low (pH 4.5-6) | 4.27 | 12.14 | -46.52 | 2 | 7 | 1 | 84 | 489.592 | 11 | ↓ |
