| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 2010 | 20 | 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) | 1.74 | 4.99 | -57.36 | 3 | 5 | 1 | 72 | 296.416 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.74 | 3.59 | -11.95 | 2 | 5 | 0 | 67 | 295.408 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.19 | 2.55 | -48.3 | 2 | 5 | 0 | 75 | 295.408 | 6 | ↓ |
