General Information of the Compound
| Compound ID |
CP0517656
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| Compound Name |
1-(3-methylphenyl)-4-(2-phenoxy-2-phenylethoxy)pyridin-2-one
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| Structure |
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| Formula |
C26H23NO3
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| Molecular Weight |
397.474
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| Canonical SMILES |
Cc1cccc(c1)-n1ccc(OCC(Oc2ccccc2)c2ccccc2)cc1=O
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| InChI |
InChI=1S/C26H23NO3/c1-20-9-8-12-22(17-20)27-16-15-24(18-26(27)28)29-19-25(21-10-4-2-5-11-21)30-23-13-6-3-7-14-23/h2-18,25H,19H2,1H3
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| InChIKey |
LNKBYGIBGUXVRV-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