General Information of the Compound
| Compound ID |
CP0536555
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| Compound Name |
4-tert-butyl-N-(4-{[(1-butyrylpiperidin-4-yl)amino]sulfonyl}-1-naphthyl)benzamide
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| Structure |
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| Formula |
C30H37N3O4S
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| Molecular Weight |
535.71
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| Canonical SMILES |
CCCC(=O)N1CCC(CC1)NS(=O)(=O)c1ccc(NC(=O)c2ccc(cc2)C(C)(C)C)c2ccccc12
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| InChI |
InChI=1S/C30H37N3O4S/c1-5-8-28(34)33-19-17-23(18-20-33)32-38(36,37)27-16-15-26(24-9-6-7-10-25(24)27)31-29(35)21-11-13-22(14-12-21)30(2,3)4/h6-7,9-16,23,32H,5,8,17-20H2,1-4H3,(H,31,35)
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| InChIKey |
NFULGCSRYNEYAI-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