| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 14th, 2008 | 31 | No |
| 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) | 4.83 | 12.62 | -17.87 | 2 | 6 | 0 | 80 | 432.549 | 4 | ↓ |
| Hi High (pH 8-9.5) | 5.01 | 12.22 | -44.72 | 1 | 6 | -1 | 82 | 431.541 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.83 | 13.38 | -74.38 | 1 | 6 | -1 | 83 | 431.541 | 4 | ↓ |
