General Information of the Compound
| Compound ID |
CP0572197
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| Compound Name |
2,6-dimethoxy-4-[(E)-2-[3-(2-phenylethyl)-1,2,4-oxadiazol-5-yl]ethenyl]phenol
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| Structure |
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| Formula |
C20H20N2O4
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| Molecular Weight |
352.39
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| Canonical SMILES |
COc1cc(\C=C\c2nc(CCc3ccccc3)no2)cc(OC)c1O
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| InChI |
InChI=1S/C20H20N2O4/c1-24-16-12-15(13-17(25-2)20(16)23)9-11-19-21-18(22-26-19)10-8-14-6-4-3-5-7-14/h3-7,9,11-13,23H,8,10H2,1-2H3/b11-9+
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| InChIKey |
SAKWHNKNFLNQQR-PKNBQFBNSA-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