| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 6th, 2008 | 29 | No |
Popular Name: (4-methyl-3-nitro-phenyl)-[4-[5-(trifluoromethyl)-2-pyridyl]-1,4-diazepan-1-yl]methanone (4-methyl-3-nitro-phenyl)-[4-[5-…
| 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) | 3.10 | 10.37 | -19.53 | 0 | 7 | 0 | 82 | 408.38 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![Phenyl-[4-(2-pyridyl)-1,4-diazepan-1-yl]methanone](http://zinc12.docking.org/img/rings/56289.gif)