General Information of the Compound
Compound ID |
CP0572514
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Compound Name |
5-chloro-N-[4-[(7,8-dimethyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)oxy]phenyl]-2-methoxybenzenesulfonamide
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Formula |
C24H20ClN5O4S
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Molecular Weight |
509.975
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Canonical SMILES |
COc1ccc(Cl)cc1S(=O)(=O)Nc1ccc(Oc2nc3cc(C)c(C)cc3n3cnnc23)cc1
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InChI |
InChI=1S/C24H20ClN5O4S/c1-14-10-19-20(11-15(14)2)30-13-26-28-23(30)24(27-19)34-18-7-5-17(6-8-18)29-35(31,32)22-12-16(25)4-9-21(22)33-3/h4-13,29H,1-3H3
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InChIKey |
IUTJESMFPKMALH-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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