In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 28th, 2011 | 26 | Yes |
Popular Name: 1-[1-(2,2-difluoroethyl)-4-piperidyl]-3-[4-(dimethylsulfamoyl)phenyl]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) | 1.75 | 4.29 | -52.61 | 3 | 7 | 1 | 83 | 391.464 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.75 | 2.22 | -17.73 | 2 | 7 | 0 | 82 | 390.456 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.