| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 15th, 2010 | 18 | Yes |
Popular Name: (1S)-N-ethyl-1-(2-fluorophenyl)-2-(2-pyridyl)ethanamine (1S)-N-ethyl-1-(2-fluorophenyl)-…
| 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) | 2.81 | 7.73 | -35.68 | 2 | 2 | 1 | 29 | 245.321 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.81 | 7.02 | -6.07 | 1 | 2 | 0 | 25 | 244.313 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.81 | 8.24 | -102 | 3 | 2 | 2 | 31 | 246.329 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
