General Information of the Compound
| Compound ID |
CP0406528
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| Compound Name |
2-(4-(1H-imidazol-1-yl)phenoxy)-4-(benzo[d][1,3]dioxol-5-yloxy)-5-methylpyrimidine
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| Structure |
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| Formula |
C21H16N4O4
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| Molecular Weight |
388.383
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| Canonical SMILES |
Cc1cnc(Oc2ccc(cc2)-n2ccnc2)nc1Oc1ccc2OCOc2c1
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| InChI |
InChI=1S/C21H16N4O4/c1-14-11-23-21(29-16-4-2-15(3-5-16)25-9-8-22-12-25)24-20(14)28-17-6-7-18-19(10-17)27-13-26-18/h2-12H,13H2,1H3
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| InChIKey |
WUDOWDUJLISJRD-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