| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 27th, 2008 | 33 | 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) | 3.49 | 7.49 | -10.69 | 1 | 7 | 0 | 77 | 450.535 | 10 | ↓ |
| Hi High (pH 8-9.5) | 3.49 | 8.25 | -50.77 | 0 | 7 | -1 | 80 | 449.527 | 10 | ↓ |
| Mid Mid (pH 6-8) | 3.49 | 10.5 | -35.57 | 1 | 7 | 0 | 81 | 450.535 | 10 | ↓ |
