General Information of the Compound
| Compound ID |
CP0905739
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| Compound Name |
(E)-3-(2,3-bis(4-methoxyphenyl)quinoxalin-6-yl)acrylic acid
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| Structure |
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| Formula |
C25H20N2O4
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| Molecular Weight |
412.445
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| Canonical SMILES |
COc1ccc(-c2nc3ccc(/C=C/C(=O)O)cc3nc2-c2ccc(OC)cc2)cc1
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| InChI |
InChI=1S/C25H20N2O4/c1-30-19-9-5-17(6-10-19)24-25(18-7-11-20(31-2)12-8-18)27-22-15-16(4-14-23(28)29)3-13-21(22)26-24/h3-15H,1-2H3,(H,28,29)/b14-4+
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| InChIKey |
BAHGGPDSMRDUMK-LNKIKWGQSA-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