General Information of the Compound
| Compound ID |
CP0552859
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| Compound Name |
N-[3-methoxy-5-[2-methyl-5-(4-piperazin-1-ylphenyl)pyridin-3-yl]phenyl]propane-2-sulfonamide
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| Structure |
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| Formula |
C26H32N4O3S
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| Molecular Weight |
480.634
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| Canonical SMILES |
COc1cc(NS(=O)(=O)C(C)C)cc(c1)-c1cc(cnc1C)-c1ccc(cc1)N1CCNCC1
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| InChI |
InChI=1S/C26H32N4O3S/c1-18(2)34(31,32)29-23-13-21(14-25(16-23)33-4)26-15-22(17-28-19(26)3)20-5-7-24(8-6-20)30-11-9-27-10-12-30/h5-8,13-18,27,29H,9-12H2,1-4H3
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| InChIKey |
MCKKWYKONXTPFI-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