| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 15th, 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) | 3.58 | 11.59 | -19.79 | 2 | 7 | 0 | 89 | 434.521 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.92 | 11.13 | -44.76 | 1 | 7 | -1 | 91 | 433.513 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.75 | 11.52 | -43.94 | 1 | 7 | -1 | 91 | 433.513 | 5 | ↓ |
