General Information of the Compound
| Compound ID |
CP0546392
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| Compound Name |
4-fluoro-N-[4-[(E)-3-(4-hydroxy-3,5-dimethylphenyl)prop-2-enoyl]phenyl]benzenesulfonamide
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| Formula |
C23H20FNO4S
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| Molecular Weight |
425.481
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| Canonical SMILES |
Cc1cc(\C=C\C(=O)c2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2)cc(C)c1O
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| InChI |
InChI=1S/C23H20FNO4S/c1-15-13-17(14-16(2)23(15)27)3-12-22(26)18-4-8-20(9-5-18)25-30(28,29)21-10-6-19(24)7-11-21/h3-14,25,27H,1-2H3/b12-3+
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| InChIKey |
UWZWZXDMHANTQO-KGVSQERTSA-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