| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 27th, 2010 | 16 | 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) | 0.24 | 2.83 | -45.4 | 3 | 4 | 1 | 47 | 221.328 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.24 | 3.28 | -82.02 | 4 | 4 | 2 | 48 | 222.336 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.24 | 5.03 | -117.55 | 4 | 4 | 2 | 48 | 222.336 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 0.24 | 5.51 | -183.73 | 5 | 4 | 3 | 49 | 223.344 | 3 | ↓ |
