| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2008 | 15 | 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) | -0.33 | 1.79 | -45.79 | 3 | 4 | 1 | 59 | 224.309 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.33 | 0.47 | -8.95 | 2 | 4 | 0 | 54 | 223.301 | 3 | ↓ |
| Lo Low (pH 4.5-6) | -0.33 | 2.23 | -93.89 | 4 | 4 | 2 | 60 | 225.317 | 3 | ↓ |
