| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 15th, 2010 | 35 | 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) | 7.46 | 12.54 | -10.16 | 2 | 6 | 0 | 78 | 475.633 | 11 | ↓ |
| Hi High (pH 8-9.5) | 7.23 | 12.85 | -53.15 | 0 | 6 | -1 | 77 | 474.625 | 11 | ↓ |
| Hi High (pH 8-9.5) | 7.23 | 13.14 | -54.04 | 0 | 6 | -1 | 77 | 474.625 | 11 | ↓ |
| Hi High (pH 8-9.5) | 7.46 | 13.49 | -38.68 | 1 | 6 | -1 | 81 | 474.625 | 11 | ↓ |
