| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 19th, 2011 | 20 | Yes |
Popular Name: (4aS)-7-(6-chloropyridazin-3-yl)-2-methyl-5,6,8,9-tetrahydro-4aH-pyrimido[4,5-d]azepin-4-one (4aS)-7-(6-chloropyridazin-3-yl)…
| 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) | 1.84 | 4.26 | -17.9 | 0 | 6 | 0 | 71 | 291.742 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![4a,5,6,7,8,9-hexahydropyrimido[4,5-d]azepin-4-one](http://zinc12.docking.org/img/rings/397911.gif)
![7-pyridazin-3-yl-5,6,8,9-tetrahydro-4aH-pyrimido[4,5-d]azepin-4-one](http://zinc12.docking.org/img/rings/416450.gif)