| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 28th, 2011 | 22 | Yes |
Popular Name: 1-(4-cyanophenyl)-3-[1-(2,2-difluoroethyl)-4-piperidyl]urea 1-(4-cyanophenyl)-3-[1-(2,2-difl…
| 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) | 2.19 | 6.73 | -48.79 | 3 | 5 | 1 | 69 | 309.34 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.19 | 4.61 | -13.58 | 2 | 5 | 0 | 68 | 308.332 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
