| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 12th, 2006 | 26 | 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) | 3.59 | 5.7 | -16.39 | 2 | 6 | 0 | 84 | 353.422 | 3 | ↓ |
| Hi High (pH 8-9.5) | 4.05 | 4.06 | -47.36 | 1 | 6 | -1 | 87 | 352.414 | 3 | ↓ |
| Hi High (pH 8-9.5) | 4.05 | 3.79 | -55.64 | 1 | 6 | -1 | 87 | 352.414 | 3 | ↓ |
