| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2009 | 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) | 3.62 | 12.08 | -13.79 | 2 | 9 | 0 | 107 | 451.527 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.69 | 10.61 | -59.19 | 1 | 9 | -1 | 114 | 450.519 | 8 | ↓ |
