General Information of the Compound
| Compound ID |
CP0497978
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| Compound Name |
2-(4-cyano-N-(4-methylphenyl)sulfonylanilino)-N-(4-cyanophenyl)acetamide
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| Structure |
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| Formula |
C23H18N4O3S
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| Molecular Weight |
430.489
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| Canonical SMILES |
Cc1ccc(cc1)S(=O)(=O)N(CC(=O)Nc1ccc(cc1)C#N)c1ccc(cc1)C#N
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| InChI |
InChI=1S/C23H18N4O3S/c1-17-2-12-22(13-3-17)31(29,30)27(21-10-6-19(15-25)7-11-21)16-23(28)26-20-8-4-18(14-24)5-9-20/h2-13H,16H2,1H3,(H,26,28)
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| InChIKey |
FZBXBBMERJSCLW-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