| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 27th, 2009 | 27 | Yes |
Popular Name: 3-[[4-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-1,4-diazepan-1-yl]methyl]benzonitrile 3-[[4-[3-chloro-5-(trifluorometh…
| 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) | 3.94 | 11.75 | -50.05 | 1 | 4 | 1 | 44 | 395.836 | 4 | ↓ |
