General Information of the Compound
| Compound ID |
CP0561685
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| Compound Name |
(E)-3-(4-hydroxy-3,5-dimethylphenyl)-1-[4-(propan-2-ylsulfamoylamino)phenyl]prop-2-en-1-one
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| Formula |
C20H24N2O4S
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| Molecular Weight |
388.489
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| Canonical SMILES |
CC(C)NS(=O)(=O)Nc1ccc(cc1)C(=O)\C=C\c1cc(C)c(O)c(C)c1
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| InChI |
InChI=1S/C20H24N2O4S/c1-13(2)21-27(25,26)22-18-8-6-17(7-9-18)19(23)10-5-16-11-14(3)20(24)15(4)12-16/h5-13,21-22,24H,1-4H3/b10-5+
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| InChIKey |
ASNVGPDEFNNXGM-BJMVGYQFSA-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