| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 18th, 2011 | 21 | No |
Popular Name: 2-(1,2,3,4-tetrahydroisoquinolin-7-yl)pyrrolo[3,4-c]pyridine-1,3-dione 2-(1,2,3,4-tetrahydroisoquinolin…
| 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) | 1.13 | 4.13 | -9.15 | 1 | 5 | 0 | 64 | 279.299 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.13 | 5.5 | -47.17 | 2 | 5 | 1 | 69 | 280.307 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![Pyrrolo[3,4-c]pyridine-1,3-quinone](http://zinc12.docking.org/img/rings/227585.gif)
![2-(1,2,3,4-tetrahydroisoquinolin-7-yl)pyrrolo[3,4-c]pyridine-1,3-quinone](http://zinc12.docking.org/img/rings/265170.gif)