| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 31st, 2005 | 22 | 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) | 5.26 | 12.22 | -10.46 | 0 | 4 | 0 | 53 | 350.546 | 17 | ↓ |
| Hi High (pH 8-9.5) | 5.26 | 13.28 | -93.14 | 0 | 4 | -2 | 53 | 348.53 | 17 | ↓ |
| Hi High (pH 8-9.5) | 5.26 | 12.75 | -49.09 | 0 | 4 | -1 | 53 | 349.538 | 17 | ↓ |
