| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 30th, 2007 | 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) | 4.83 | 8.12 | -16.53 | 3 | 6 | 0 | 89 | 463.896 | 4 | ↓ |
| Ref Reference (pH 7) | 4.83 | 8.06 | -12.24 | 3 | 6 | 0 | 89 | 463.896 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.81 | 7.92 | -54.08 | 1 | 6 | -1 | 88 | 462.888 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.81 | 8.12 | -50.58 | 1 | 6 | -1 | 88 | 462.888 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.83 | 8.88 | -42.65 | 2 | 6 | -1 | 92 | 462.888 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.83 | 8.85 | -48.96 | 2 | 6 | -1 | 92 | 462.888 | 4 | ↓ |
