| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 29th, 2008 | 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) | 4.21 | 6.67 | -9.56 | 2 | 4 | 0 | 57 | 330.185 | 2 | ↓ |
| Ref Reference (pH 7) | 4.03 | 6.66 | -28 | 3 | 4 | 1 | 55 | 331.193 | 3 | ↓ |
| Hi High (pH 8-9.5) | 5.39 | 5.56 | -46.76 | 1 | 4 | -1 | 64 | 329.177 | 2 | ↓ |
| Hi High (pH 8-9.5) | 4.66 | 4.63 | -47.48 | 1 | 4 | -1 | 60 | 329.177 | 2 | ↓ |
| Hi High (pH 8-9.5) | 5.39 | 4.64 | -39.67 | 1 | 4 | -1 | 64 | 329.177 | 2 | ↓ |
