| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 2nd, 2005 | 19 | 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) | 2.46 | 4.18 | -7.75 | 2 | 4 | 0 | 58 | 258.321 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.83 | -0.18 | -44.11 | 1 | 4 | -1 | 68 | 257.313 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.83 | 0.78 | -29.29 | 2 | 4 | 0 | 70 | 258.321 | 3 | ↓ |
