General Information of the Compound
| Compound ID |
CP0549172
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| Compound Name |
2-[2-[(E)-2-[4-(trifluoromethylsulfonyl)phenyl]ethenyl]-3H-benzimidazol-5-yl]benzenesulfonamide
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| Structure |
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| Formula |
C22H16F3N3O4S2
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| Molecular Weight |
507.515
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| Canonical SMILES |
NS(=O)(=O)c1ccccc1-c1ccc2[nH]c(\C=C\c3ccc(cc3)S(=O)(=O)C(F)(F)F)nc2c1
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| InChI |
InChI=1S/C22H16F3N3O4S2/c23-22(24,25)33(29,30)16-9-5-14(6-10-16)7-12-21-27-18-11-8-15(13-19(18)28-21)17-3-1-2-4-20(17)34(26,31)32/h1-13H,(H,27,28)(H2,26,31,32)/b12-7+
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| InChIKey |
RICHUFIPOKYOBA-KPKJPENVSA-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