| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 23rd, 2010 | 22 | Yes |
Popular Name: pyrrolidin-1-yl-[1-[3-(2,2,2-trifluoroethoxy)propyl]-4-piperidyl]methanone pyrrolidin-1-yl-[1-[3-(2,2,2-tri…
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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) | 2.05 | 7.85 | -49.12 | 1 | 4 | 1 | 34 | 323.379 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.05 | 5.63 | -12.18 | 0 | 4 | 0 | 33 | 322.371 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
