| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 9th, 2009 | 28 | 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) | 4.74 | 7.81 | -10.91 | 2 | 5 | 0 | 82 | 455.23 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.74 | 8.73 | -45.9 | 1 | 5 | -1 | 85 | 454.222 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.93 | 7.3 | -97.45 | 0 | 5 | -2 | 92 | 453.214 | 6 | ↓ |
