| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 18th, 2008 | 32 | 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) | 3.59 | 1.94 | -10.73 | 3 | 8 | 0 | 108 | 457.914 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.59 | 2.72 | -40.92 | 2 | 8 | -1 | 111 | 456.906 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.14 | 4.56 | -70.2 | 2 | 8 | -1 | 111 | 456.906 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.14 | 4 | -69.66 | 2 | 8 | -1 | 111 | 456.906 | 5 | ↓ |
