| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 1st, 2009 | 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) | 3.60 | 5.27 | -13.64 | 2 | 7 | 0 | 102 | 447.896 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.60 | 6.02 | -51.51 | 1 | 7 | -1 | 105 | 446.888 | 5 | ↓ |
