| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 18th, 2009 | 22 | 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) | 1.64 | 7.99 | -116.71 | 4 | 5 | 2 | 67 | 322.478 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.64 | 6.56 | -46.6 | 3 | 5 | 1 | 62 | 321.47 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.09 | 6.92 | -92.74 | 3 | 5 | 1 | 70 | 321.47 | 7 | ↓ |
