General Information of the Compound
| Compound ID |
CP0910970
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| Compound Name |
N-((5-(4-(trifluoromethyl)benzyl)-1,3,4-oxadiazol-2-yl)methyl)-N-(3-chloro-2-methylphenyl)-4-methylbenzenesulfonamide
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| Structure |
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| Formula |
C25H21ClF3N3O3S
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| Molecular Weight |
535.975
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| Canonical SMILES |
Cc1ccc(S(=O)(=O)N(Cc2nnc(Cc3ccc(C(F)(F)F)cc3)o2)c2cccc(Cl)c2C)cc1
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| InChI |
InChI=1S/C25H21ClF3N3O3S/c1-16-6-12-20(13-7-16)36(33,34)32(22-5-3-4-21(26)17(22)2)15-24-31-30-23(35-24)14-18-8-10-19(11-9-18)25(27,28)29/h3-13H,14-15H2,1-2H3
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| InChIKey |
YVMHJIQXDGRVGH-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