| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2011 | 23 | Yes |
Popular Name: 2-(methylamino)-1-[(3R)-3-[2-[3-(trifluoromethyl)phenyl]ethyl]-1-piperidyl]ethanone 2-(methylamino)-1-[(3R)-3-[2-[3-…
| 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) | 3.42 | 9.13 | -43.06 | 2 | 3 | 1 | 37 | 329.386 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.42 | 7.69 | -9.1 | 1 | 3 | 0 | 32 | 328.378 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
