General Information of the Compound
| Compound ID |
CP0550912
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| Compound Name |
methyl (2E)-2-[2-[(3-hydroxyphenoxy)methyl]phenyl]-2-methoxyiminoacetate
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| Structure |
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| Formula |
C17H17NO5
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| Molecular Weight |
315.325
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| Canonical SMILES |
CO\N=C(\C(=O)OC)c1ccccc1COc1cccc(O)c1
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| InChI |
InChI=1S/C17H17NO5/c1-21-17(20)16(18-22-2)15-9-4-3-6-12(15)11-23-14-8-5-7-13(19)10-14/h3-10,19H,11H2,1-2H3/b18-16+
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| InChIKey |
WKBUTPWSBVPMOQ-FBMGVBCBSA-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