| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 27th, 2008 | 31 | No |
None
| 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) | 3.22 | 8.87 | -53.66 | 1 | 6 | 1 | 56 | 425.48 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.22 | 5.95 | -9.58 | 0 | 6 | 0 | 55 | 424.472 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.22 | 8.28 | -49.99 | 1 | 6 | 1 | 56 | 425.48 | 4 | ↓ |
