| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 19th, 2011 | 22 | Yes |
Popular Name: (3aR)-2-[2-(1,3-benzothiazol-2-yl)ethyl]-5,6,7,8-tetrahydro-3aH-imidazo[4,5-c]azepin-4-one (3aR)-2-[2-(1,3-benzothiazol-2-y…
| 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) | 2.16 | 5.07 | -20.58 | 2 | 5 | 0 | 71 | 312.398 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.16 | 5.47 | -38.93 | 3 | 5 | 1 | 72 | 313.406 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![5,6,7,8-tetrahydro-1H-imidazo[4,5-c]azepin-4-one](http://zinc12.docking.org/img/rings/397071.gif)
![2-[2-(1,3-benzothiazol-2-yl)ethyl]-5,6,7,8-tetrahydro-1H-imidazo[4,5-c]azepin-4-one](http://zinc12.docking.org/img/rings/420664.gif)