| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 18th, 2009 | 22 | 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) | 2.29 | 4.51 | -51.74 | 4 | 5 | 1 | 83 | 322.454 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.29 | 3.34 | -13.77 | 3 | 5 | 0 | 78 | 321.446 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.75 | 3.45 | -42.46 | 3 | 5 | 0 | 86 | 321.446 | 5 | ↓ |
