| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 15th, 2010 | 39 | 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) | 7.12 | 13.76 | -11.33 | 2 | 6 | 0 | 78 | 515.613 | 6 | ↓ |
| Hi High (pH 8-9.5) | 6.89 | 14.1 | -53.69 | 0 | 6 | -1 | 77 | 514.605 | 6 | ↓ |
| Hi High (pH 8-9.5) | 6.89 | 14.84 | -57.06 | 0 | 6 | -1 | 77 | 514.605 | 6 | ↓ |
| Hi High (pH 8-9.5) | 7.12 | 14.64 | -40.19 | 1 | 6 | -1 | 81 | 514.605 | 6 | ↓ |
