General Information of the Compound
| Compound ID |
CP0866059
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| Compound Name |
N-[4-Chloro-2-(1-oxy-pyridine-4-carbonyl)-phenyl]-4-(4-methyltetrahydropyran-4-yl)-benzenesulfonamide
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| Structure |
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| Formula |
C24H23ClN2O5S
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| Molecular Weight |
486.977
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| Canonical SMILES |
CC1(c2ccc(S(=O)(=O)Nc3ccc(Cl)cc3C(=O)c3cc[n+]([O-])cc3)cc2)CCOCC1
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| InChI |
InChI=1S/C24H23ClN2O5S/c1-24(10-14-32-15-11-24)18-2-5-20(6-3-18)33(30,31)26-22-7-4-19(25)16-21(22)23(28)17-8-12-27(29)13-9-17/h2-9,12-13,16,26H,10-11,14-15H2,1H3
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| InChIKey |
MICKPVYGVLKJJJ-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