| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 22nd, 2008 | 32 | 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) | 2.65 | 8.94 | -55.74 | 3 | 6 | 1 | 71 | 478.013 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.65 | 6.69 | -18.86 | 2 | 6 | 0 | 70 | 477.005 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.65 | 8.65 | -48.32 | 3 | 6 | 1 | 71 | 478.013 | 6 | ↓ |
