| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 11th, 2011 | 23 | No |
Popular Name: (E)-1-[4-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1-piperidyl]-3-phenyl-prop-2-en-1-one (E)-1-[4-(1-methyl-3,6-dihydro-2…
| 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) | 3.41 | 11.42 | -42.76 | 1 | 3 | 1 | 25 | 311.449 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.41 | 9.01 | -8.42 | 0 | 3 | 0 | 24 | 310.441 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![3-phenyl-1-[4-(1,2,3,6-tetrahydropyridin-4-yl)piperidino]prop-2-en-1-one](http://zinc12.docking.org/img/rings/564821.gif)