| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2008 | 19 | Yes |
Popular Name: (2S)-2-(azocan-1-yl)-2-(3-bromo-4-fluoro-phenyl)ethanamine (2S)-2-(azocan-1-yl)-2-(3-bromo-…
| 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) | 3.55 | 7.91 | -137.33 | 4 | 2 | 2 | 32 | 331.273 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.55 | 6.66 | -56.19 | 3 | 2 | 1 | 31 | 330.265 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.55 | 7.63 | -35.81 | 3 | 2 | 1 | 30 | 330.265 | 3 | ↓ |
