| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 13th, 2008 | 29 | 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) | 2.35 | 7.05 | -32.56 | 3 | 5 | 1 | 55 | 404.481 | 9 | ↓ |
| Hi High (pH 8-9.5) | 2.35 | 4.88 | -11.47 | 2 | 5 | 0 | 54 | 403.473 | 9 | ↓ |
| Hi High (pH 8-9.5) | 2.35 | 6.17 | -45.33 | 3 | 5 | 1 | 58 | 404.481 | 9 | ↓ |
