| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 12th, 2008 | 11 | Yes |
Popular Name: 3-methylisoxazolo[5,4-d]pyrimidin-4(5H)-one 3-methylisoxazolo[5,4-d]pyrimidi…
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CAS Number: 68571-74-4
3-Methylisoxazolo[5,4-d]pyrimidin-4(2H)-one
| 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) | -0.21 | 0.52 | -15.58 | 1 | 5 | 0 | 72 | 151.125 | 0 | ↓ |
| Mid Mid (pH 6-8) | 0.25 | -0.6 | -34.67 | 0 | 5 | -1 | 75 | 150.117 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
No pre-computed analogs available. Try a structural similarity search.