General Information of the Compound
| Compound ID |
CP0952993
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| Compound Name |
N-[4-Chloro-2-(2-methyl-pyridine-3-carbonyl)-phenyl]-4-(4-methyl-tetrahydropyran-4-yl)-benzenesulfonamide
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| Structure |
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| Formula |
C25H25ClN2O4S
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| Molecular Weight |
485.005
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| Canonical SMILES |
Cc1ncccc1C(=O)c1cc(Cl)ccc1NS(=O)(=O)c1ccc(C2(C)CCOCC2)cc1
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| InChI |
InChI=1S/C25H25ClN2O4S/c1-17-21(4-3-13-27-17)24(29)22-16-19(26)7-10-23(22)28-33(30,31)20-8-5-18(6-9-20)25(2)11-14-32-15-12-25/h3-10,13,16,28H,11-12,14-15H2,1-2H3
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| InChIKey |
GWJRFVGBHBERQB-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