General Information of the Compound
| Compound ID |
CP0887509
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| Compound Name |
N-(thiazol-2-yl)-4-(4-(trifluoromethyl)phenethylsulfonyl)benzenesulfonamide
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| Structure |
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| Formula |
C18H15F3N2O4S3
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| Molecular Weight |
476.523
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| Canonical SMILES |
O=S(=O)(CCc1ccc(C(F)(F)F)cc1)c1ccc(S(=O)(=O)Nc2nccs2)cc1
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| InChI |
InChI=1S/C18H15F3N2O4S3/c19-18(20,21)14-3-1-13(2-4-14)9-12-29(24,25)15-5-7-16(8-6-15)30(26,27)23-17-22-10-11-28-17/h1-8,10-11H,9,12H2,(H,22,23)
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| InChIKey |
UKBXMPOJYMOHJQ-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