| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 2010 | 18 | Yes |
Popular Name: 3-[[4-(dimethylamino)butylamino]methyl]-4-fluoro-benzonitrile 3-[[4-(dimethylamino)butylamino]…
| 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) | 1.91 | 8.54 | -101.93 | 3 | 3 | 2 | 45 | 251.349 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.91 | 7.17 | -37.1 | 2 | 3 | 1 | 40 | 250.341 | 7 | ↓ |
