General Information of the Compound
| Compound ID |
CP0572513
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| Compound Name |
5-chloro-2-methoxy-N-[4-[(1-methyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)oxy]phenyl]benzenesulfonamide
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| Structure |
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| Formula |
C23H18ClN5O4S
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| Molecular Weight |
495.948
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| Canonical SMILES |
COc1ccc(Cl)cc1S(=O)(=O)Nc1ccc(Oc2nc3ccccc3n3c(C)nnc23)cc1
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| InChI |
InChI=1S/C23H18ClN5O4S/c1-14-26-27-22-23(25-18-5-3-4-6-19(18)29(14)22)33-17-10-8-16(9-11-17)28-34(30,31)21-13-15(24)7-12-20(21)32-2/h3-13,28H,1-2H3
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| InChIKey |
CEQIVTKDMUURDY-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