General Information of the Compound
| Compound ID |
CP0418944
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| Compound Name |
(E)-1-[4-amino-3-(3,4-dimethoxyphenyl)phenyl]-3-(2,5-dimethoxyphenyl)prop-2-en-1-one
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| Structure |
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| Formula |
C25H25NO5
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| Molecular Weight |
419.477
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| Canonical SMILES |
COc1ccc(OC)c(\C=C\C(=O)c2ccc(N)c(c2)-c2ccc(OC)c(OC)c2)c1
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| InChI |
InChI=1S/C25H25NO5/c1-28-19-8-12-23(29-2)18(13-19)6-10-22(27)17-5-9-21(26)20(14-17)16-7-11-24(30-3)25(15-16)31-4/h5-15H,26H2,1-4H3/b10-6+
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| InChIKey |
ADGORNBDNFUYSV-UXBLZVDNSA-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