| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2010 | 21 | Yes |
Popular Name: 4-[2-(1-piperidyl)ethylamino]quinoline-3-carbonitrile 4-[2-(1-piperidyl)ethylamino]qui…
| 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) | 2.70 | 7.8 | -40.8 | 2 | 4 | 1 | 53 | 281.383 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.70 | 5.6 | -7.5 | 1 | 4 | 0 | 52 | 280.375 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.70 | 8.22 | -86.09 | 3 | 4 | 2 | 54 | 282.391 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
