| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 15th, 2010 | 33 | 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) | 6.11 | 11.15 | -9.82 | 2 | 6 | 0 | 78 | 447.579 | 8 | ↓ |
| Hi High (pH 8-9.5) | 5.88 | 11.37 | -53.3 | 0 | 6 | -1 | 77 | 446.571 | 8 | ↓ |
| Hi High (pH 8-9.5) | 5.88 | 11.56 | -44.43 | 0 | 6 | -1 | 77 | 446.571 | 8 | ↓ |
| Hi High (pH 8-9.5) | 6.11 | 12.05 | -46.67 | 1 | 6 | -1 | 81 | 446.571 | 8 | ↓ |
