In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 27th, 2011 | 18 | Yes |
Popular Name: 5-[(1R)-1-[4-(2,2-difluoroethyl)piperazin-1-yl]ethyl]-3-methyl-1,2,4-oxadiazole 5-[(1R)-1-[4-(2,2-difluoroethyl)…
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) | 0.84 | 0.66 | -8.54 | 0 | 5 | 0 | 45 | 260.288 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.84 | 2.83 | -38.09 | 1 | 5 | 1 | 47 | 261.296 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.