| 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) | 5.87 | 11.06 | -10.17 | 2 | 6 | 0 | 78 | 445.563 | 8 | ↓ |
| Hi High (pH 8-9.5) | 5.64 | 10.92 | -53.61 | 0 | 6 | -1 | 77 | 444.555 | 8 | ↓ |
| Hi High (pH 8-9.5) | 5.64 | 10.87 | -52.6 | 0 | 6 | -1 | 77 | 444.555 | 8 | ↓ |
| Hi High (pH 8-9.5) | 5.87 | 11.88 | -46.81 | 1 | 6 | -1 | 81 | 444.555 | 8 | ↓ |
