| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2010 | 27 | No |
Popular Name: (E)-3-[4-[(4-nitrophenyl)methylene]-1-piperidyl]-1-(p-tolyl)prop-2-en-1-one (E)-3-[4-[(4-nitrophenyl)methyle…
| 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) | 4.77 | 13.6 | -31.78 | 0 | 5 | 0 | 66 | 362.429 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.77 | 13.63 | -30.14 | 0 | 5 | 0 | 66 | 362.429 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
