| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 10th, 2009 | 37 | 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) | 5.36 | 11.11 | -42.34 | 2 | 8 | 1 | 84 | 545.491 | 10 | ↓ |
| Hi High (pH 8-9.5) | 5.36 | 8.64 | -9.35 | 1 | 8 | 0 | 83 | 544.483 | 10 | ↓ |
| Mid Mid (pH 6-8) | 5.36 | 10.97 | -45.82 | 2 | 8 | 1 | 84 | 545.491 | 10 | ↓ |
