General Information of the Compound
| Compound ID |
CP0557120
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| Compound Name |
ethyl 8-methoxy-4-[4-(2-methoxyphenyl)-3-methylpiperazin-1-yl]quinoline-3-carboxylate
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| Formula |
C25H29N3O4
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| Molecular Weight |
435.524
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| Canonical SMILES |
CCOC(=O)c1cnc2c(OC)cccc2c1N1CCN(C(C)C1)c1ccccc1OC
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| InChI |
InChI=1S/C25H29N3O4/c1-5-32-25(29)19-15-26-23-18(9-8-12-22(23)31-4)24(19)27-13-14-28(17(2)16-27)20-10-6-7-11-21(20)30-3/h6-12,15,17H,5,13-14,16H2,1-4H3
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| InChIKey |
MRXJEJZQICXGFB-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