| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 2004 | 21 | Yes |
Popular Name: 4-[4-[3-(trifluoromethyl)pyridin-1-ium-2-yl]piperazin-1-ium-1-yl]butyronitrile 4-[4-[3-(trifluoromethyl)pyridin…
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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) | 1.61 | 3.19 | -111.31 | 2 | 4 | 2 | 45 | 300.328 | 5 | ↓ |
