| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 11th, 2008 | 30 | Yes |
| 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) | 3.69 | 6.77 | -14.07 | 3 | 7 | 0 | 104 | 443.912 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.15 | 5.68 | -45.27 | 2 | 7 | -1 | 107 | 442.904 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.33 | 6.09 | -38.66 | 3 | 7 | 0 | 112 | 443.912 | 5 | ↓ |
