General Information of the Compound
| Compound ID |
CP0504157
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| Compound Name |
(E)-1-[4-amino-3-(4-fluorophenyl)phenyl]-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one
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| Structure |
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| Formula |
C24H22FNO4
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| Molecular Weight |
407.441
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| Canonical SMILES |
COc1cc(\C=C\C(=O)c2ccc(N)c(c2)-c2ccc(F)cc2)cc(OC)c1OC
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| InChI |
InChI=1S/C24H22FNO4/c1-28-22-12-15(13-23(29-2)24(22)30-3)4-11-21(27)17-7-10-20(26)19(14-17)16-5-8-18(25)9-6-16/h4-14H,26H2,1-3H3/b11-4+
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| InChIKey |
AXGFPSAMCXTLRQ-NYYWCZLTSA-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
Protein ID: PT02635, Transcription factor p65
Cell Viability or Cytotoxicity Assay