General Information of the Compound
| Compound ID |
CP0456564
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| Compound Name |
N-(3-acetylphenyl)-2-[(4-tert-butylbenzoyl)amino]benzamide
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| Structure |
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| Formula |
C26H26N2O3
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| Molecular Weight |
414.505
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| Canonical SMILES |
CC(=O)c1cccc(NC(=O)c2ccccc2NC(=O)c2ccc(cc2)C(C)(C)C)c1
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| InChI |
InChI=1S/C26H26N2O3/c1-17(29)19-8-7-9-21(16-19)27-25(31)22-10-5-6-11-23(22)28-24(30)18-12-14-20(15-13-18)26(2,3)4/h5-16H,1-4H3,(H,27,31)(H,28,30)
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| InChIKey |
GPQYZRHYWVYERQ-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