| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2004 | 25 | 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) | 3.12 | 6.91 | -56.2 | 4 | 6 | 1 | 92 | 343.403 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.12 | 7.91 | -82.5 | 3 | 6 | 0 | 95 | 342.395 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.12 | 5.55 | -12.61 | 3 | 6 | 0 | 88 | 342.395 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.12 | 6.55 | -52.79 | 2 | 6 | -1 | 90 | 341.387 | 9 | ↓ |
