| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 15th, 2010 | 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) | 5.64 | 9.65 | -9.84 | 2 | 5 | 0 | 69 | 409.917 | 5 | ↓ |
| Hi High (pH 8-9.5) | 5.41 | 9.99 | -51.68 | 0 | 5 | -1 | 68 | 408.909 | 5 | ↓ |
| Hi High (pH 8-9.5) | 5.41 | 10.3 | -51.58 | 0 | 5 | -1 | 68 | 408.909 | 5 | ↓ |
| Hi High (pH 8-9.5) | 5.64 | 10.64 | -35.1 | 1 | 5 | -1 | 72 | 408.909 | 5 | ↓ |
