| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2009 | 18 | 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) | 0.97 | 6.18 | -185.04 | 5 | 4 | 3 | 49 | 251.398 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.97 | 3.55 | -4.77 | 2 | 4 | 0 | 45 | 248.374 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.97 | 3.95 | -45.63 | 3 | 4 | 1 | 47 | 249.382 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.97 | 4.28 | -81.76 | 4 | 4 | 2 | 48 | 250.39 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.97 | 5.83 | -112.08 | 4 | 4 | 2 | 48 | 250.39 | 5 | ↓ |
