General Information of the Compound
| Compound ID |
CP0906611
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| Compound Name |
N-(thiazol-2-yl)-4-(5-(4-(trifluoromethyl)benzyl)-4H-1,2,4-triazol-3-yl)benzenesulfonamide
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| Structure |
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| Formula |
C19H14F3N5O2S2
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| Molecular Weight |
465.482
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| Canonical SMILES |
O=S(=O)(Nc1nccs1)c1ccc(-c2nnc(Cc3ccc(C(F)(F)F)cc3)[nH]2)cc1
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| InChI |
InChI=1S/C19H14F3N5O2S2/c20-19(21,22)14-5-1-12(2-6-14)11-16-24-17(26-25-16)13-3-7-15(8-4-13)31(28,29)27-18-23-9-10-30-18/h1-10H,11H2,(H,23,27)(H,24,25,26)
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| InChIKey |
ZICNGTHTROYZIB-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