General Information of the Compound
| Compound ID |
CP0554527
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| Compound Name |
4-(3,4-difluorophenoxy)-7H-pyrrolo[2,3-d]pyrimidine
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| Structure |
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| Formula |
C12H7F2N3O
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| Molecular Weight |
247.204
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| Canonical SMILES |
Fc1ccc(Oc2ncnc3[nH]ccc23)cc1F
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| InChI |
InChI=1S/C12H7F2N3O/c13-9-2-1-7(5-10(9)14)18-12-8-3-4-15-11(8)16-6-17-12/h1-6H,(H,15,16,17)
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| InChIKey |
MHVONIOEJOVODB-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound