| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 31st, 2010 | 28 | 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) | 2.49 | 9.71 | -53.45 | 5 | 7 | 1 | 71 | 426.632 | 13 | ↓ |
| Hi High (pH 8-9.5) | 2.49 | 7.37 | -18.33 | 4 | 7 | 0 | 70 | 425.624 | 13 | ↓ |
