General Information of the Compound
| Compound ID |
CP0947502
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| Compound Name |
N-[4-Chloro-2-(6-methylpyridine-3-carbonyl)-phenyl]-4-oxazol-5-yl-benzenesulfonamide
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| Structure |
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| Formula |
C22H16ClN3O4S
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| Molecular Weight |
453.907
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| Canonical SMILES |
Cc1ccc(C(=O)c2cc(Cl)ccc2NS(=O)(=O)c2ccc(-c3cnco3)cc2)cn1
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| InChI |
InChI=1S/C22H16ClN3O4S/c1-14-2-3-16(11-25-14)22(27)19-10-17(23)6-9-20(19)26-31(28,29)18-7-4-15(5-8-18)21-12-24-13-30-21/h2-13,26H,1H3
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| InChIKey |
LMCTYGSRGRBZQE-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