| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 11th, 2011 | 23 | Yes |
Popular Name: 2,3-dimethyl-7-(9H-purin-6-yl)-5,6,8,9-tetrahydropyrimido[4,5-d]azepin-4-one 2,3-dimethyl-7-(9H-purin-6-yl)-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) | 0.76 | 8.49 | -17.79 | 1 | 8 | 0 | 93 | 311.349 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![3,5,6,7,8,9-hexahydropyrimido[4,5-d]azepin-4-one](http://zinc12.docking.org/img/rings/397488.gif)
![7-(9H-purin-6-yl)-5,6,8,9-tetrahydro-3H-pyrimido[4,5-d]azepin-4-one](http://zinc12.docking.org/img/rings/564238.gif)