In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2010 | 32 | Yes |
Popular Name: 5-[2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxo-ethoxy]-2-(morpholinomethyl)pyran-4-one 5-[2-[4-(2-methoxyphenyl)piperaz…
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) | 0.65 | 7.01 | -27.31 | 0 | 9 | 0 | 85 | 443.5 | 7 | ↓ |
Lo Low (pH 4.5-6) | 0.65 | 9.31 | -70.96 | 1 | 9 | 1 | 86 | 444.508 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.