| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2008 | 18 | Yes |
Popular Name: (1S)-N-[(2,4-difluorophenyl)methyl]-1-(2-pyridyl)ethanamine (1S)-N-[(2,4-difluorophenyl)meth…
| 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) | 2.54 | 7.41 | -39.17 | 2 | 2 | 1 | 29 | 249.284 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.54 | 6.11 | -5.86 | 1 | 2 | 0 | 25 | 248.276 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
