| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2009 | 20 | 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) | 3.40 | 5.96 | -45.94 | 3 | 4 | 1 | 62 | 280.388 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.40 | 3.98 | -10.79 | 2 | 4 | 0 | 61 | 279.38 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.40 | 6.9 | -62.7 | 2 | 4 | 0 | 65 | 279.38 | 9 | ↓ |
