| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 18 | Yes |
| 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) | 3.33 | 7.79 | -59.7 | 2 | 4 | 0 | 57 | 248.326 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.33 | 5.39 | -49.14 | 1 | 4 | -1 | 55 | 247.318 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.33 | 5.8 | -35.45 | 3 | 4 | 1 | 54 | 249.334 | 4 | ↓ |
