| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 23rd, 2011 | 15 | Yes |
Popular Name: 4-{7H-pyrrolo[2,3-d]pyrimidin-4-yl}morpholine 4-{7H-pyrrolo[2,3-d]pyrimidin-4-…
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CAS Numbers: 90870-83-0 , [90870-83-0]
4-(1H-Pyrrolo[2,3-d]pyrimidin-4-yl)morpholine
4-(4-Morpholinyl)-1H-pyrrolo[2,3-d]pyrimidine
| 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) | 0.62 | 4.52 | -8.62 | 1 | 5 | 0 | 54 | 204.233 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 0.62 | 4.99 | -32.81 | 2 | 5 | 1 | 55 | 205.241 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 211 - 212 | KeyOrganics |
| MP | 211-212° | Matrix Scientific |
| Purity | >95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
| PUBCHEM_PATENT_ID | WO1999065909A1 | IBM Patent Data |
No pre-computed analogs available. Try a structural similarity search.
![7H-pyrrolo[2,3-d]pyrimidine](http://zinc12.docking.org/img/rings/7073.gif)
![4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)morpholine](http://zinc12.docking.org/img/rings/286856.gif)