In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 5th, 2008 | 25 | Yes |
Popular Name: [4-(2-pyridyl)piperazin-1-yl]-[4-(trifluoromethylsulfanyl)phenyl]methanone [4-(2-pyridyl)piperazin-1-yl]-[4…
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) | 5.58 | 8.35 | -36.99 | 1 | 4 | 1 | 38 | 368.404 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.