General Information of the Compound
| Compound ID |
CP0551285
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| Compound Name |
4-(3,4-Dimethoxy-phenyl)-2-isopropyl-5,6,7-trimethoxy-quinoline-3-carboxylic acid ethyl ester
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| Structure |
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| Formula |
C26H31NO7
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| Molecular Weight |
469.534
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| Canonical SMILES |
CCOC(=O)c1c(nc2cc(OC)c(OC)c(OC)c2c1-c1ccc(OC)c(OC)c1)C(C)C
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| InChI |
InChI=1S/C26H31NO7/c1-9-34-26(28)22-20(15-10-11-17(29-4)18(12-15)30-5)21-16(27-23(22)14(2)3)13-19(31-6)24(32-7)25(21)33-8/h10-14H,9H2,1-8H3
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| InChIKey |
GZAZASNGTVBRJK-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