| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 17th, 2009 | 33 | Yes |
Popular Name: 2-(4-acetamidophenyl)-N-[2-(4-ethylpiperazin-1-yl)ethyl]quinoline-4-carboxamide 2-(4-acetamidophenyl)-N-[2-(4-et…
| 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) | 2.77 | 7.92 | -46.99 | 3 | 7 | 1 | 79 | 446.575 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.36 | 0.98 | -15.39 | 2 | 7 | 0 | 85 | 445.567 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.77 | 5.69 | -23.96 | 2 | 7 | 0 | 78 | 445.567 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.36 | 3.25 | -98.17 | 4 | 7 | 2 | 87 | 447.583 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.77 | 8.01 | -66.89 | 3 | 7 | 1 | 79 | 446.575 | 7 | ↓ |
