| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 17th, 2009 | 13 | 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) | -0.98 | 0.78 | -57.9 | 4 | 4 | 1 | 74 | 179.199 | 1 | ↓ |
| Hi High (pH 8-9.5) | -0.98 | 0.44 | -8.55 | 3 | 4 | 0 | 72 | 178.191 | 1 | ↓ |
| Hi High (pH 8-9.5) | -0.52 | -1.85 | -81.53 | 3 | 4 | 0 | 77 | 178.191 | 1 | ↓ |
| Hi High (pH 8-9.5) | -0.52 | -2.2 | -46.59 | 2 | 4 | -1 | 75 | 177.183 | 1 | ↓ |
