General Information of the Compound
| Compound ID |
CP0484317
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| Compound Name |
2-(2-ethyl-N-(4-methylphenyl)sulfonylanilino)-N-[(4-methoxyphenyl)methyl]acetamide
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| Structure |
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| Formula |
C25H28N2O4S
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| Molecular Weight |
452.576
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| Canonical SMILES |
CCc1ccccc1N(CC(=O)NCc1ccc(OC)cc1)S(=O)(=O)c1ccc(C)cc1
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| InChI |
InChI=1S/C25H28N2O4S/c1-4-21-7-5-6-8-24(21)27(32(29,30)23-15-9-19(2)10-16-23)18-25(28)26-17-20-11-13-22(31-3)14-12-20/h5-16H,4,17-18H2,1-3H3,(H,26,28)
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| InChIKey |
BVZAJOYDXJRMGX-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