| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 15th, 2010 | 33 | 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) | 4.97 | 9.66 | -11.5 | 2 | 6 | 0 | 78 | 439.515 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.75 | 10.88 | -45.62 | 0 | 6 | -1 | 77 | 438.507 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.75 | 10.39 | -54.06 | 0 | 6 | -1 | 77 | 438.507 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.97 | 10.5 | -38.94 | 1 | 6 | -1 | 81 | 438.507 | 5 | ↓ |
