| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 22nd, 2010 | 21 | Yes |
Popular Name: 2-[methyl(4-quinolyl)amino]-1-piperazin-1-yl-ethanone 2-[methyl(4-quinolyl)amino]-1-pi…
| 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) | 0.92 | 6.79 | -85.13 | 3 | 5 | 2 | 54 | 286.379 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.92 | 5.06 | -11.18 | 1 | 5 | 0 | 48 | 284.363 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.92 | 5.5 | -31.71 | 2 | 5 | 1 | 50 | 285.371 | 3 | ↓ |
