General Information of the Compound
| Compound ID |
CP0417060
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| Compound Name |
(E)-1-[4-amino-3-(4-fluorophenyl)phenyl]-3-(3,4-dimethoxyphenyl)prop-2-en-1-one
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| Structure |
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| Formula |
C23H20FNO3
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| Molecular Weight |
377.415
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| Canonical SMILES |
COc1ccc(\C=C\C(=O)c2ccc(N)c(c2)-c2ccc(F)cc2)cc1OC
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| InChI |
InChI=1S/C23H20FNO3/c1-27-22-12-4-15(13-23(22)28-2)3-11-21(26)17-7-10-20(25)19(14-17)16-5-8-18(24)9-6-16/h3-14H,25H2,1-2H3/b11-3+
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| InChIKey |
DVGQGVAFWKXCHR-QDEBKDIKSA-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