| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 5th, 2009 | 28 | 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) | 3.79 | 10.49 | -57.59 | 1 | 9 | -1 | 119 | 435.898 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.86 | 9.6 | -86.02 | 0 | 9 | -2 | 125 | 434.89 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.06 | 10.66 | -27.23 | 2 | 9 | 0 | 121 | 436.906 | 6 | ↓ |
