General Information of the Compound
| Compound ID |
CP0432649
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| Compound Name |
((+/-)-N-(4-{[(1-butyrylpyrrolidin-3-yl)amino]sulfonyl}-1-naphthyl)-2-methylbenzamide
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| Structure |
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| Formula |
C26H29N3O4S
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| Molecular Weight |
479.602
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| Canonical SMILES |
CCCC(=O)N1CCC(C1)NS(=O)(=O)c1ccc(NC(=O)c2ccccc2C)c2ccccc12
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| InChI |
InChI=1S/C26H29N3O4S/c1-3-8-25(30)29-16-15-19(17-29)28-34(32,33)24-14-13-23(21-11-6-7-12-22(21)24)27-26(31)20-10-5-4-9-18(20)2/h4-7,9-14,19,28H,3,8,15-17H2,1-2H3,(H,27,31)
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| InChIKey |
LSBLBSMFNCZRSR-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