| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 3rd, 2006 | 25 | 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) | 3.23 | 8.78 | -17.52 | 2 | 6 | 0 | 80 | 356.451 | 2 | ↓ |
| Hi High (pH 8-9.5) | 3.41 | 8.08 | -41.38 | 1 | 6 | -1 | 82 | 355.443 | 2 | ↓ |
| Hi High (pH 8-9.5) | 3.23 | 9.46 | -73.83 | 1 | 6 | -1 | 83 | 355.443 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 3.57 | 9.59 | -26.63 | 3 | 6 | 1 | 85 | 357.459 | 2 | ↓ |
