General Information of the Compound
| Compound ID |
CP0880587
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| Compound Name |
2-amino-N-(5-bromo-2-methoxy-4-((3-methyl-2,4-dioxothiazolidin-5-ylidene)methyl)phenyl)thiazole-4-sulfonamide
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| Structure |
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| Formula |
C15H13BrN4O5S3
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| Molecular Weight |
505.397
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| Canonical SMILES |
COc1cc(/C=C2\SC(=O)N(C)C2=O)c(Br)cc1NS(=O)(=O)c1csc(N)n1
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| InChI |
InChI=1S/C15H13BrN4O5S3/c1-20-13(21)11(27-15(20)22)4-7-3-10(25-2)9(5-8(7)16)19-28(23,24)12-6-26-14(17)18-12/h3-6,19H,1-2H3,(H2,17,18)/b11-4-
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| InChIKey |
KOFXEFYJGOGEEP-WCIBSUBMSA-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