| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 8th, 2008 | 23 | Yes |
Popular Name: 2-[2-[(2S)-2-methyl-1-piperidyl]ethylamino]quinoline-4-carboxylic 2-[2-[(2S)-2-methyl-1-piperidyl]…
| 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) | 3.21 | 8.25 | -69.12 | 2 | 5 | 0 | 69 | 313.401 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.21 | 5.97 | -52.22 | 1 | 5 | -1 | 68 | 312.393 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.21 | 8.68 | -97.59 | 3 | 5 | 1 | 71 | 314.409 | 5 | ↓ |
