| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 6th, 2008 | 28 | Yes |
Popular Name: (2-hydroxy-4-methoxy-phenyl)-[4-[5-(trifluoromethyl)-2-pyridyl]-1,4-diazepan-1-yl]methanone (2-hydroxy-4-methoxy-phenyl)-[4-…
| 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) | 3.29 | 5.76 | -16.58 | 1 | 6 | 0 | 66 | 395.381 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.29 | 6.55 | -57.87 | 0 | 6 | -1 | 69 | 394.373 | 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)