| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 26th, 2008 | 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) | 3.03 | 7.58 | -38.38 | 3 | 5 | 1 | 55 | 438.926 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.03 | 5.46 | -10.87 | 2 | 5 | 0 | 54 | 437.918 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.03 | 6.73 | -46.78 | 3 | 5 | 1 | 58 | 438.926 | 9 | ↓ |
