| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 16th, 2008 | 33 | No |
| 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) | -4.04 | 3.39 | -92 | 4 | 13 | -1 | 191 | 474.535 | 18 | ↓ |
| Hi High (pH 8-9.5) | -4.04 | 1.16 | -135.65 | 3 | 13 | -2 | 189 | 473.527 | 18 | ↓ |
| Lo Low (pH 4.5-6) | -4.04 | 3.49 | -110.33 | 4 | 13 | -1 | 191 | 474.535 | 18 | ↓ |
