| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 16th, 2009 | 36 | 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) | -0.08 | -0.37 | -115.67 | 6 | 10 | 2 | 117 | 512.692 | 18 | ↓ |
| Hi High (pH 8-9.5) | -0.08 | -1.78 | -60.6 | 5 | 10 | 1 | 113 | 511.684 | 18 | ↓ |
| Hi High (pH 8-9.5) | -0.08 | -1.9 | -60.09 | 5 | 10 | 1 | 113 | 511.684 | 18 | ↓ |
| Lo Low (pH 4.5-6) | -0.08 | 1.97 | -191.52 | 7 | 10 | 3 | 118 | 513.7 | 18 | ↓ |
| Lo Low (pH 4.5-6) | -0.08 | 1.97 | -191.37 | 7 | 10 | 3 | 118 | 513.7 | 18 | ↓ |
