| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 29th, 2009 | 30 | 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) | 0.18 | -6.38 | -20.73 | 7 | 9 | 0 | 168 | 418.398 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.18 | -5.39 | -74.03 | 6 | 9 | -1 | 171 | 417.39 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.18 | -5.39 | -75.77 | 6 | 9 | -1 | 171 | 417.39 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.18 | -5.4 | -78.77 | 6 | 9 | -1 | 171 | 417.39 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.18 | -5.4 | -72.08 | 6 | 9 | -1 | 171 | 417.39 | 3 | ↓ |
