| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2008 | 13 | 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) | -0.18 | 1.18 | -52.06 | 3 | 4 | 1 | 59 | 180.231 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.18 | -0.24 | -12.82 | 2 | 4 | 0 | 54 | 179.223 | 4 | ↓ |
| Lo Low (pH 4.5-6) | -0.18 | 0.3 | -37.15 | 3 | 4 | 1 | 55 | 180.231 | 4 | ↓ |
