| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 15th, 2010 | 31 | 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) | 5.08 | 8.58 | -12.42 | 2 | 6 | 0 | 78 | 460.361 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.85 | 9.36 | -41.82 | 0 | 6 | -1 | 77 | 459.353 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.85 | 8.88 | -51.78 | 0 | 6 | -1 | 77 | 459.353 | 6 | ↓ |
| Hi High (pH 8-9.5) | 5.08 | 9.42 | -35.79 | 1 | 6 | -1 | 81 | 459.353 | 6 | ↓ |
