| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 12th, 2008 | 22 | 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) | 1.88 | 3.52 | -45.81 | 2 | 5 | 1 | 46 | 329.848 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.88 | 1.11 | -9.07 | 1 | 5 | 0 | 45 | 328.84 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 1.88 | 5.8 | -117.04 | 3 | 5 | 2 | 48 | 330.856 | 8 | ↓ |
