| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 5th, 2008 | 31 | Yes |
Popular Name: N-(2,3-dimethylphenyl)-2-[4-(2-hydroxyquinoline-4-carbonyl)piperazin-1-yl]acetamide N-(2,3-dimethylphenyl)-2-[4-(2-h…
| 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) | 2.22 | 8.05 | -60.98 | 3 | 7 | 1 | 87 | 419.505 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.22 | 5.81 | -23.94 | 2 | 7 | 0 | 86 | 418.497 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.13 | 7.03 | -74.98 | 2 | 7 | 0 | 90 | 418.497 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.13 | 4.65 | -54.74 | 1 | 7 | -1 | 89 | 417.489 | 4 | ↓ |
