| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 21st, 2011 | 14 | 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) | 3.69 | 8.59 | -36.21 | 1 | 1 | 1 | 4 | 218.792 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.69 | 6.69 | -0.62 | 0 | 1 | 0 | 3 | 217.784 | 3 | ↓ |
