General Information of the Compound
| Compound ID |
CP0214923
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| Compound Name |
N-[2-chloro-4-[(2-chlorophenyl)sulfonyl-prop-2-enylamino]phenyl]-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide
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| Structure |
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| Formula |
C19H17Cl2F3N2O4S
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| Molecular Weight |
497.322
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| Canonical SMILES |
CC(O)(C(=O)Nc1ccc(cc1Cl)N(CC=C)S(=O)(=O)c1ccccc1Cl)C(F)(F)F
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| InChI |
InChI=1S/C19H17Cl2F3N2O4S/c1-3-10-26(31(29,30)16-7-5-4-6-13(16)20)12-8-9-15(14(21)11-12)25-17(27)18(2,28)19(22,23)24/h3-9,11,28H,1,10H2,2H3,(H,25,27)
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| InChIKey |
NPQCUKWVPMFTSZ-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