| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 15th, 2010 | 34 | 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) | 5.14 | 9.73 | -11.93 | 2 | 6 | 0 | 78 | 457.505 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.91 | 10.95 | -44.68 | 0 | 6 | -1 | 77 | 456.497 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.91 | 10.46 | -54.32 | 0 | 6 | -1 | 77 | 456.497 | 5 | ↓ |
| Hi High (pH 8-9.5) | 5.14 | 10.57 | -37.63 | 1 | 6 | -1 | 81 | 456.497 | 5 | ↓ |
