| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 21st, 2008 | 12 | Yes |
None
| 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) | -0.59 | 1.98 | -183.94 | 7 | 3 | 3 | 61 | 176.328 | 9 | ↓ |
| Hi High (pH 8-9.5) | -0.59 | 1.6 | -103.69 | 6 | 3 | 2 | 59 | 175.32 | 9 | ↓ |
| Hi High (pH 8-9.5) | -0.59 | 0.26 | -36.96 | 5 | 3 | 1 | 55 | 174.312 | 9 | ↓ |
