| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 25th, 2008 | 27 | 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) | 3.26 | 2.79 | -45.53 | 1 | 7 | -1 | 104 | 450.652 | 3 | ↓ |
| Ref Reference (pH 7) | 3.26 | 2.91 | -44.14 | 1 | 7 | -1 | 104 | 450.652 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.26 | 3.84 | -104.16 | 0 | 7 | -2 | 107 | 449.644 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.26 | 3.71 | -102.39 | 0 | 7 | -2 | 107 | 449.644 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.81 | 5.34 | -12.25 | 2 | 7 | 0 | 101 | 451.66 | 3 | ↓ |
