| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 28th, 2011 | 23 | No |
Popular Name: 1-[1-(2,2-difluoroethyl)-4-piperidyl]-3-(3-nitrophenyl)urea 1-[1-(2,2-difluoroethyl)-4-piper…
| 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) | 2.37 | 7.04 | -52.45 | 3 | 7 | 1 | 91 | 329.327 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.37 | 4.93 | -19.05 | 2 | 7 | 0 | 90 | 328.319 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
