General Information of the Compound
| Compound ID |
CP0848989
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| Compound Name |
N-(4-chloro-2-isonicotinoylphenyl)-4-(3,5-dimethylisoxazol-4-yl)benzenesulfonamide
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| Structure |
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| Formula |
C23H18ClN3O4S
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| Molecular Weight |
467.934
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| Canonical SMILES |
Cc1noc(C)c1-c1ccc(S(=O)(=O)Nc2ccc(Cl)cc2C(=O)c2ccncc2)cc1
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| InChI |
InChI=1S/C23H18ClN3O4S/c1-14-22(15(2)31-26-14)16-3-6-19(7-4-16)32(29,30)27-21-8-5-18(24)13-20(21)23(28)17-9-11-25-12-10-17/h3-13,27H,1-2H3
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| InChIKey |
CFCVYMWGFHGGRF-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