General Information of the Compound
| Compound ID |
CP0531933
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| Compound Name |
N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-1-(4-methylphenyl)sulfonylpiperazine-2-carboxamide
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| Structure |
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| Formula |
C22H24N4O4S2
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| Molecular Weight |
472.592
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| Canonical SMILES |
COc1ccc(cc1)-c1csc(NC(=O)C2CNCCN2S(=O)(=O)c2ccc(C)cc2)n1
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| InChI |
InChI=1S/C22H24N4O4S2/c1-15-3-9-18(10-4-15)32(28,29)26-12-11-23-13-20(26)21(27)25-22-24-19(14-31-22)16-5-7-17(30-2)8-6-16/h3-10,14,20,23H,11-13H2,1-2H3,(H,24,25,27)
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| InChIKey |
KOIHPOHJCCHBHO-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