General Information of the Compound
| Compound ID |
CP0197606
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| Compound Name |
3-[[4-(2-piperidin-1-ylpyridin-4-yl)pyrimidin-2-yl]amino]benzenesulfonamide
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| Structure |
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| Formula |
C20H22N6O2S
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| Molecular Weight |
410.503
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| Canonical SMILES |
NS(=O)(=O)c1cccc(Nc2nccc(n2)-c2ccnc(c2)N2CCCCC2)c1
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| InChI |
InChI=1S/C20H22N6O2S/c21-29(27,28)17-6-4-5-16(14-17)24-20-23-10-8-18(25-20)15-7-9-22-19(13-15)26-11-2-1-3-12-26/h4-10,13-14H,1-3,11-12H2,(H2,21,27,28)(H,23,24,25)
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| InChIKey |
CZDONRYGQBBPBK-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