| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2008 | 39 | 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) | 4.80 | 9.65 | -64.02 | 0 | 8 | -1 | 95 | 531.629 | 9 | ↓ |
| Mid Mid (pH 6-8) | 4.80 | 11.98 | -75.36 | 1 | 8 | 0 | 96 | 532.637 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 4.80 | 11.16 | -48.49 | 2 | 8 | 1 | 94 | 533.645 | 9 | ↓ |
