| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 18th, 2009 | 36 | 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) | 4.52 | 13.5 | -14 | 1 | 5 | 0 | 54 | 477.608 | 8 | ↓ |
| Mid Mid (pH 6-8) | 4.52 | 15.32 | -44.62 | 2 | 5 | 1 | 56 | 478.616 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 4.52 | 15.77 | -86.59 | 3 | 5 | 2 | 57 | 479.624 | 8 | ↓ |
