| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 20th, 2010 | 30 | No |
None
None
| 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) | 4.33 | 9.61 | -40.44 | 2 | 5 | 1 | 58 | 405.518 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.33 | 8.11 | -44.75 | 0 | 5 | -1 | 60 | 403.502 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.33 | 10.37 | -51.07 | 1 | 5 | 0 | 61 | 404.51 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.33 | 7.35 | -8.58 | 1 | 5 | 0 | 57 | 404.51 | 5 | ↓ |
