| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 17th, 2009 | 33 | Yes |
Popular Name: N-[2-(4-methylpiperazin-1-yl)ethyl]-2-[4-(propanoylamino)phenyl]quinoline-4-carboxamide N-[2-(4-methylpiperazin-1-yl)eth…
| 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) | 3.24 | 8.14 | -60.07 | 3 | 7 | 1 | 79 | 446.575 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.24 | 8.01 | -66.46 | 3 | 7 | 1 | 79 | 446.575 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.24 | 5.67 | -23.84 | 2 | 7 | 0 | 78 | 445.567 | 7 | ↓ |
