| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 17th, 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) | 3.61 | 4.68 | -45.83 | 4 | 5 | 1 | 79 | 340.513 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.17 | 2.62 | -14.45 | 3 | 5 | 0 | 77 | 339.505 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.43 | 3.39 | -38.64 | 3 | 5 | 0 | 85 | 339.505 | 5 | ↓ |
