| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 18th, 2011 | 25 | Yes |
Popular Name: 7-chloro-2-(2-isobutyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-6-yl)-4-methyl-quinoline 7-chloro-2-(2-isobutyl-5,7-dihyd…
| 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) | 4.45 | 10.78 | -8.5 | 0 | 4 | 0 | 42 | 352.869 | 3 | ↓ |
| Mid Mid (pH 6-8) | 4.45 | 11.15 | -32.01 | 1 | 4 | 1 | 43 | 353.877 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidine](http://zinc12.docking.org/img/rings/398161.gif)
![2-(5,7-dihydropyrrolo[3,4-d]pyrimidin-6-yl)quinoline](http://zinc12.docking.org/img/rings/523610.gif)