| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 4th, 2011 | 24 | Yes |
Popular Name: N-[2-[(1R,2S)-2-methylcyclohexoxy]ethyl]-4-oxo-1H-quinoline-3-carboxamide N-[2-[(1R,2S)-2-methylcyclohexox…
| 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) | 1.96 | 7.28 | -14.38 | 2 | 5 | 0 | 71 | 328.412 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.26 | 7.12 | -53.42 | 1 | 5 | -1 | 74 | 327.404 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![N-[2-(cyclohexoxy)ethyl]-4-keto-1H-quinoline-3-carboxamide](http://zinc12.docking.org/img/rings/180610.gif)