| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 2nd, 2011 | 35 | Yes |
| 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) | 0.09 | 11.51 | -61.04 | 1 | 8 | 1 | 78 | 476.601 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.09 | 9.28 | -20.66 | 0 | 8 | 0 | 77 | 475.593 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![2,3,3a,4-tetrahydropyrrolo[1,2-a]quinazoline-1,5-quinone](http://zinc12.docking.org/img/rings/16074.gif)
![3-(1,5-diketo-3,3a-dihydro-2H-pyrrolo[1,2-a]quinazolin-4-yl)-N-[1-(4-pyridylmethyl)-4-piperidyl]propionamide](http://zinc12.docking.org/img/rings/518592.gif)