| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 30th, 2009 | 28 | 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) | 4.52 | 6.48 | -11.61 | 2 | 6 | 0 | 82 | 503.205 | 3 | ↓ |
| Hi High (pH 8-9.5) | 4.52 | 7.85 | -40.49 | 1 | 6 | -1 | 85 | 502.197 | 3 | ↓ |
| Hi High (pH 8-9.5) | 4.52 | 7.24 | -17.17 | 1 | 6 | 0 | 85 | 502.197 | 3 | ↓ |
