| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 6th, 2007 | 30 | 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) | 3.49 | 8.04 | -23.99 | 2 | 10 | 0 | 135 | 449.876 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.49 | 7.9 | -42.79 | 1 | 10 | -1 | 133 | 448.868 | 9 | ↓ |
