| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 5th, 2010 | 31 | 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) | 3.79 | 8.54 | -14.98 | 3 | 9 | 0 | 114 | 485.342 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.79 | 9.45 | -50.66 | 2 | 9 | -1 | 117 | 484.334 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.60 | 7.76 | -36.03 | 2 | 9 | -1 | 121 | 484.334 | 5 | ↓ |
