General Information of the Compound
| Compound ID |
CP0850719
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| Compound Name |
N-[4-Chloro-2-(2-methyl-1-oxy-pyridine-3-carbonyl)-phenyl]-4-isopropoxy-benzenesulfonamide
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| Structure |
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| Formula |
C22H21ClN2O5S
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| Molecular Weight |
460.939
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| Canonical SMILES |
Cc1c(C(=O)c2cc(Cl)ccc2NS(=O)(=O)c2ccc(OC(C)C)cc2)ccc[n+]1[O-]
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| InChI |
InChI=1S/C22H21ClN2O5S/c1-14(2)30-17-7-9-18(10-8-17)31(28,29)24-21-11-6-16(23)13-20(21)22(26)19-5-4-12-25(27)15(19)3/h4-14,24H,1-3H3
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| InChIKey |
QEIMSJXHWROQQP-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