General Information of the Compound
| Compound ID |
CP0526972
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| Compound Name |
(2R)-N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-1-(1-methylimidazol-4-yl)sulfonylpiperidine-2-carboxamide
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| Structure |
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| Formula |
C20H23N5O4S2
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| Molecular Weight |
461.569
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| Canonical SMILES |
COc1ccc(cc1)-c1csc(NC(=O)[C@H]2CCCCN2S(=O)(=O)c2cn(C)cn2)n1
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| InChI |
InChI=1S/C20H23N5O4S2/c1-24-11-18(21-13-24)31(27,28)25-10-4-3-5-17(25)19(26)23-20-22-16(12-30-20)14-6-8-15(29-2)9-7-14/h6-9,11-13,17H,3-5,10H2,1-2H3,(H,22,23,26)/t17-/m1/s1
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| InChIKey |
SKGWPMOJLSALPR-QGZVFWFLSA-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