| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 29th, 2008 | 32 | 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) | 1.21 | 3.34 | -23.4 | 5 | 11 | 0 | 161 | 432.396 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.13 | 0.42 | -113.66 | 3 | 11 | -2 | 168 | 430.38 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.67 | 2.2 | -51.12 | 4 | 11 | -1 | 164 | 431.388 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![1,7-dihydropyrrolo[2,3-d]pyrimidine-2,4-quinone](http://zinc12.docking.org/img/rings/57182.gif)
![5-(2,4-diketo-6-pyrrol-1-yl-1H-pyrimidin-5-yl)-6-phenyl-1,7-dihydropyrrolo[2,3-d]pyrimidine-2,4-quinone](http://zinc12.docking.org/img/rings/80362.gif)