| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 21st, 2010 | 20 | Yes |
Popular Name: 1-(3,4-difluorophenyl)-2-[methyl-[[(2S)-tetrahydropyran-2-yl]methyl]amino]ethanone 1-(3,4-difluorophenyl)-2-[methyl…
| 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) | 2.63 | 8.41 | -48.82 | 1 | 3 | 1 | 31 | 284.326 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.63 | 6.15 | -11.28 | 0 | 3 | 0 | 30 | 283.318 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
