| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 23rd, 2010 | 24 | No |
Popular Name: 1-pyrrolidin-1-yl-2-[4-[3-(2,2,2-trifluoroethoxy)propyl]piperazin-1-yl]ethane-1,2-dione 1-pyrrolidin-1-yl-2-[4-[3-(2,2,2…
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| 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) | 0.49 | 3.92 | -8.9 | 0 | 6 | 0 | 53 | 351.369 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 0.49 | 6.13 | -45.47 | 1 | 6 | 1 | 54 | 352.377 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
