| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 25th, 2011 | 19 | Yes |
Popular Name: (1S)-1-(2,4-difluorophenyl)-N-[[(2R)-4-methylmorpholin-2-yl]methyl]ethanamine (1S)-1-(2,4-difluorophenyl)-N-[[…
| 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) | 2.17 | 4.6 | -42.2 | 2 | 3 | 1 | 29 | 271.331 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.17 | 3.41 | -3.57 | 1 | 3 | 0 | 24 | 270.323 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.17 | 7.02 | -108.08 | 3 | 3 | 2 | 30 | 272.339 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.17 | 5.84 | -38.72 | 2 | 3 | 1 | 26 | 271.331 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
