| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 29th, 2008 | 22 | Yes |
| 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) | 3.74 | 11.89 | -113.42 | 3 | 2 | 2 | 21 | 296.458 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.74 | 10.59 | -37.31 | 2 | 2 | 1 | 16 | 295.45 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.74 | 9.49 | -40.39 | 2 | 2 | 1 | 20 | 295.45 | 5 | ↓ |
