| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 4th, 2011 | 36 | 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) | 3.04 | 7.86 | -16.03 | 2 | 11 | 0 | 149 | 491.552 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.49 | 4.93 | -59.37 | 1 | 11 | -1 | 152 | 490.544 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 3.04 | 7.91 | -46 | 3 | 11 | 1 | 150 | 492.56 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![1H-pyrido[2,3-d]pyrimidine-2,4-quinone](http://zinc12.docking.org/img/rings/4146.gif)
![2,4-diketo-N-[[3-(3-pyridyl)-1,2,4-oxadiazol-5-yl]methyl]-1H-pyrido[2,3-d]pyrimidine-5-carboxamide](http://zinc12.docking.org/img/rings/262915.gif)