| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 15th, 2010 | 36 | 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) | 7.22 | 12.79 | -10.8 | 2 | 6 | 0 | 78 | 481.596 | 8 | ↓ |
| Hi High (pH 8-9.5) | 6.99 | 12.97 | -52.82 | 0 | 6 | -1 | 77 | 480.588 | 8 | ↓ |
| Hi High (pH 8-9.5) | 6.99 | 13.41 | -55.25 | 0 | 6 | -1 | 77 | 480.588 | 8 | ↓ |
| Hi High (pH 8-9.5) | 7.22 | 13.75 | -40.33 | 1 | 6 | -1 | 81 | 480.588 | 8 | ↓ |
