| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 25th, 2008 | 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) | 6.47 | 9.39 | -7.69 | 1 | 4 | 0 | 54 | 437.746 | 3 | ↓ |
| Hi High (pH 8-9.5) | 6.92 | 7.33 | -46.4 | 0 | 4 | -1 | 58 | 436.738 | 3 | ↓ |
| Hi High (pH 8-9.5) | 6.92 | 6.99 | -47.81 | 0 | 4 | -1 | 58 | 436.738 | 3 | ↓ |
