| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 21st, 2010 | 19 | Yes |
Popular Name: 1-(4-bromophenyl)-2-[methyl-[[(2S)-tetrahydropyran-2-yl]methyl]amino]ethanone 1-(4-bromophenyl)-2-[methyl-[[(2…
| 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) | 3.18 | 8.92 | -42.1 | 1 | 3 | 1 | 31 | 327.242 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.18 | 6.66 | -7.98 | 0 | 3 | 0 | 30 | 326.234 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
