General Information of the Compound
| Compound ID |
CP0533525
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| Compound Name |
2-[4-[2-(3-chlorophenyl)-6-ethylpyrimidin-4-yl]oxyphenyl]ethanol
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| Structure |
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| Formula |
C20H19ClN2O2
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| Molecular Weight |
354.837
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| Canonical SMILES |
CCc1cc(Oc2ccc(CCO)cc2)nc(n1)-c1cccc(Cl)c1
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| InChI |
InChI=1S/C20H19ClN2O2/c1-2-17-13-19(25-18-8-6-14(7-9-18)10-11-24)23-20(22-17)15-4-3-5-16(21)12-15/h3-9,12-13,24H,2,10-11H2,1H3
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| InChIKey |
HCLCGWQIAMYHKR-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