| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2005 | 25 | 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) | 0.31 | -0.88 | -59.44 | 7 | 10 | 1 | 157 | 351.339 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.77 | -1.48 | -61.26 | 6 | 10 | 0 | 160 | 350.331 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.31 | -0.64 | -18.72 | 6 | 10 | 0 | 156 | 350.331 | 5 | ↓ |
