| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2008 | 31 | 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) | 2.44 | 7.09 | -83.54 | 2 | 8 | 0 | 104 | 426.469 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.44 | 8.12 | -139.5 | 1 | 8 | -1 | 106 | 425.461 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.44 | 5.6 | -132.73 | 0 | 8 | -2 | 105 | 424.453 | 8 | ↓ |
