In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 26th, 2011 | 20 | Yes |
Popular Name: 3-[4-(2,2-difluoroethyl)piperazin-1-yl]-5,6-dimethyl-pyridazine-4-carbonitrile 3-[4-(2,2-difluoroethyl)piperazi…
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) | 1.59 | 5.37 | -9.93 | 0 | 5 | 0 | 56 | 281.31 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.59 | 7.44 | -39.25 | 1 | 5 | 1 | 57 | 282.318 | 3 | ↓ |