| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 23rd, 2011 | 19 | Yes |
Popular Name: 1-Isopentyl-7-(methylthio)-1H-pyrimido-[4,5-d][1,3]oxazine-2,4-dione 1-Isopentyl-7-(methylthio)-1H-py…
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CAS Numbers: 1186049-75-1 , [1186049-75-1]
| 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) | 2.32 | 7.56 | -6.14 | 0 | 6 | 0 | 78 | 281.337 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.
![1H-pyrimido[4,5-d][1,3]oxazine-2,4-quinone](http://zinc12.docking.org/img/rings/286820.gif)