| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2010 | 20 | Yes |
Popular Name: N-benzyl-2-[(3R)-3-(trifluoromethyl)-1-piperidyl]ethanamine N-benzyl-2-[(3R)-3-(trifluoromet…
| 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) | 3.23 | 7.1 | -43.92 | 2 | 2 | 1 | 20 | 287.349 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.23 | 5.73 | -2.87 | 1 | 2 | 0 | 15 | 286.341 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.23 | 9.32 | -128.19 | 3 | 2 | 2 | 21 | 288.357 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
