General Information of the Compound
| Compound ID |
CP0556740
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| Compound Name |
ethyl 4-(4-methoxyphenyl)-2-methyl-6-phenyl-1,4-dihydropyridine-3-carboxylate
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| Structure |
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| Formula |
C22H23NO3
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| Molecular Weight |
349.43
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| Canonical SMILES |
CCOC(=O)C1=C(C)NC(=CC1c1ccc(OC)cc1)c1ccccc1
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| InChI |
InChI=1S/C22H23NO3/c1-4-26-22(24)21-15(2)23-20(17-8-6-5-7-9-17)14-19(21)16-10-12-18(25-3)13-11-16/h5-14,19,23H,4H2,1-3H3
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| InChIKey |
JYPNNRSXCADAMA-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