| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 19th, 2011 | 31 | Yes |
Popular Name: 1-[[(1S)-1-cyclohexyl-3,4-dihydro-1H-isoquinolin-2-yl]methyl]-4-oxo-quinolizine-3-carboxylic 1-[[(1S)-1-cyclohexyl-3,4-dihydr…
| 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) | 4.88 | 13.42 | -77.68 | 0 | 5 | -1 | 65 | 415.513 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.88 | 15.58 | -90.56 | 1 | 5 | 0 | 66 | 416.521 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![1-[(1-cyclohexyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]quinolizin-4-one](http://zinc12.docking.org/img/rings/469607.gif)