| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 17th, 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) | 5.55 | 13.62 | -103.94 | 4 | 5 | 2 | 59 | 499.577 | 8 | ↓ |
| Hi High (pH 8-9.5) | 5.55 | 12.18 | -58.68 | 3 | 5 | 1 | 55 | 498.569 | 8 | ↓ |
| Hi High (pH 8-9.5) | 5.55 | 11.37 | -44.92 | 3 | 5 | 1 | 58 | 498.569 | 8 | ↓ |
