General Information of the Compound
| Compound ID |
CP0932499
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| Compound Name |
N-(3-chloro-2-methylphenyl)-N-((5-((4-methoxyphenylamino)methyl)-1,3,4-oxadiazol-2-yl)methyl)-4-methylbenzenesulfonamide
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| Structure |
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| Formula |
C25H25ClN4O4S
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| Molecular Weight |
513.019
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| Canonical SMILES |
COc1ccc(NCc2nnc(CN(c3cccc(Cl)c3C)S(=O)(=O)c3ccc(C)cc3)o2)cc1
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| InChI |
InChI=1S/C25H25ClN4O4S/c1-17-7-13-21(14-8-17)35(31,32)30(23-6-4-5-22(26)18(23)2)16-25-29-28-24(34-25)15-27-19-9-11-20(33-3)12-10-19/h4-14,27H,15-16H2,1-3H3
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| InChIKey |
QABPYSVXENFUHQ-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