| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 12th, 2010 | 20 | Yes |
Popular Name: (1S)-N-[2-(azepan-1-yl)ethyl]-1-(2,4-difluorophenyl)ethanamine (1S)-N-[2-(azepan-1-yl)ethyl]-1-…
| 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) | 3.75 | 9.82 | -126.6 | 3 | 2 | 2 | 21 | 284.394 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.75 | 7.74 | -45.12 | 2 | 2 | 1 | 20 | 283.386 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.75 | 8.7 | -36.62 | 2 | 2 | 1 | 16 | 283.386 | 5 | ↓ |
