| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2010 | 20 | Yes |
Popular Name: 3-methyl-N-[2-[(3S)-3-(trifluoromethyl)-1-piperidyl]ethyl]aniline 3-methyl-N-[2-[(3S)-3-(trifluoro…
| 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) | 3.95 | 8.84 | -43.6 | 2 | 2 | 1 | 16 | 287.349 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.95 | 6.61 | -3.4 | 1 | 2 | 0 | 15 | 286.341 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
