| 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) | 6.05 | 12.29 | -10.8 | 2 | 5 | 0 | 69 | 457.961 | 4 | ↓ |
| Hi High (pH 8-9.5) | 5.82 | 12.49 | -51.32 | 0 | 5 | -1 | 68 | 456.953 | 4 | ↓ |
| Hi High (pH 8-9.5) | 5.82 | 12.67 | -42.73 | 0 | 5 | -1 | 68 | 456.953 | 4 | ↓ |
| Hi High (pH 8-9.5) | 6.05 | 13.16 | -43.99 | 1 | 5 | -1 | 72 | 456.953 | 4 | ↓ |
