General Information of the Compound
| Compound ID |
CP0493821
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| Compound Name |
N-(2,4-difluorophenyl)-2-[5-methoxy-3-[(E)-[(4-methylphenyl)sulfonylhydrazinylidene]methyl]indol-1-yl]acetamide
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| Structure |
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| Formula |
C25H22F2N4O4S
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| Molecular Weight |
512.538
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| Canonical SMILES |
COc1ccc2n(CC(=O)Nc3ccc(F)cc3F)cc(\C=N\NS(=O)(=O)c3ccc(C)cc3)c2c1
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| InChI |
InChI=1S/C25H22F2N4O4S/c1-16-3-7-20(8-4-16)36(33,34)30-28-13-17-14-31(24-10-6-19(35-2)12-21(17)24)15-25(32)29-23-9-5-18(26)11-22(23)27/h3-14,30H,15H2,1-2H3,(H,29,32)/b28-13+
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| InChIKey |
MSWRCVHQJKMBCZ-XODNFHPESA-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