| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 12th, 2009 | 16 | 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) | -0.65 | 1.25 | -47.41 | 4 | 5 | 1 | 77 | 228.316 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.46 | 1.98 | -55.77 | 3 | 5 | 0 | 83 | 227.308 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.65 | 0.87 | -5.15 | 3 | 5 | 0 | 75 | 227.308 | 5 | ↓ |
