General Information of the Compound
| Compound ID |
CP0192166
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| Compound Name |
4-[[4-[3-(piperidine-1-carbonyl)phenyl]pyrimidin-2-yl]amino]benzenesulfonamide
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| Structure |
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| Formula |
C22H23N5O3S
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| Molecular Weight |
437.525
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| Canonical SMILES |
NS(=O)(=O)c1ccc(Nc2nccc(n2)-c2cccc(c2)C(=O)N2CCCCC2)cc1
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| InChI |
InChI=1S/C22H23N5O3S/c23-31(29,30)19-9-7-18(8-10-19)25-22-24-12-11-20(26-22)16-5-4-6-17(15-16)21(28)27-13-2-1-3-14-27/h4-12,15H,1-3,13-14H2,(H2,23,29,30)(H,24,25,26)
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| InChIKey |
AMGRGTYETFMYTK-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