General Information of the Compound
| Compound ID |
CP0866309
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| Compound Name |
N-[4-Chloro-2-(1-oxy-pyridine-4-carbonyl)-phenyl]-4-morpholin-4-yl-3-fluorobenzenesulfonamide
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| Structure |
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| Formula |
C22H19ClFN3O5S
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| Molecular Weight |
491.928
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| Canonical SMILES |
O=C(c1cc[n+]([O-])cc1)c1cc(Cl)ccc1NS(=O)(=O)c1ccc(N2CCOCC2)c(F)c1
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| InChI |
InChI=1S/C22H19ClFN3O5S/c23-16-1-3-20(18(13-16)22(28)15-5-7-27(29)8-6-15)25-33(30,31)17-2-4-21(19(24)14-17)26-9-11-32-12-10-26/h1-8,13-14,25H,9-12H2
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| InChIKey |
ORTVKHPKQRZATD-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