General Information of the Compound
| Compound ID |
CP0528423
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| Compound Name |
ethyl 4-[4-(2-methoxyphenyl)piperazin-1-yl]pyridine-3-carboxylate
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| Formula |
C19H23N3O3
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| Molecular Weight |
341.411
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| Canonical SMILES |
CCOC(=O)c1cnccc1N1CCN(CC1)c1ccccc1OC
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| InChI |
InChI=1S/C19H23N3O3/c1-3-25-19(23)15-14-20-9-8-16(15)21-10-12-22(13-11-21)17-6-4-5-7-18(17)24-2/h4-9,14H,3,10-13H2,1-2H3
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| InChIKey |
QLORXPYXPWPIGA-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