| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 3rd, 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) | 3.80 | 13.07 | -34.45 | 1 | 6 | 1 | 50 | 421.956 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.80 | 12.75 | -9.91 | 0 | 6 | 0 | 48 | 420.948 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.80 | 13.41 | -81.77 | 2 | 6 | 2 | 51 | 422.964 | 4 | ↓ |
