| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 10th, 2011 | 35 | Yes |
| 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) | 4.39 | 14.51 | -45.37 | 2 | 7 | 1 | 70 | 470.597 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.39 | 14.18 | -19.66 | 1 | 7 | 0 | 69 | 469.589 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![N-[4-[2-keto-2-[4-(2-pyridyl)piperazino]ethyl]phenyl]-2,3,4,5-tetrahydro-1-benzazepine-1-carboxamide](http://zinc12.docking.org/img/rings/392090.gif)