| 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) | 5.52 | 11.22 | -11.82 | 2 | 6 | 0 | 78 | 471.532 | 6 | ↓ |
| Hi High (pH 8-9.5) | 5.29 | 11.78 | -44.43 | 0 | 6 | -1 | 77 | 470.524 | 6 | ↓ |
| Hi High (pH 8-9.5) | 5.29 | 11.56 | -54.23 | 0 | 6 | -1 | 77 | 470.524 | 6 | ↓ |
| Hi High (pH 8-9.5) | 5.52 | 12.34 | -38.3 | 1 | 6 | -1 | 81 | 470.524 | 6 | ↓ |
