| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2008 | 23 | 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) | 3.21 | 7.39 | -44.04 | 1 | 5 | 1 | 47 | 337.875 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.21 | 5.03 | -6.38 | 0 | 5 | 0 | 45 | 336.867 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 3.21 | 9.73 | -119.73 | 2 | 5 | 2 | 48 | 338.883 | 9 | ↓ |
