General Information of the Compound
| Compound ID |
CP0406529
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| Compound Name |
4-(4-(1H-imidazol-1-yl)phenoxy)-2-(benzo[d][1,3]dioxol-5-yloxy)pyrimidine
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| Structure |
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| Formula |
C20H14N4O4
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| Molecular Weight |
374.356
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| Canonical SMILES |
C1Oc2ccc(Oc3nccc(Oc4ccc(cc4)-n4ccnc4)n3)cc2O1
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| InChI |
InChI=1S/C20H14N4O4/c1-3-15(4-2-14(1)24-10-9-21-12-24)27-19-7-8-22-20(23-19)28-16-5-6-17-18(11-16)26-13-25-17/h1-12H,13H2
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| InChIKey |
VEWOKEGQNVXJDK-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