General Information of the Compound
| Compound ID |
CP0893441
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| Compound Name |
N-(4-(5-(3,4-dihydroxyphenyl)-3-oxopentyl)phenyl)-2-(thiophen-2-yl)acetamide
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| Structure |
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| Formula |
C23H23NO4S
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| Molecular Weight |
409.507
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| Canonical SMILES |
O=C(CCc1ccc(NC(=O)Cc2cccs2)cc1)CCc1ccc(O)c(O)c1
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| InChI |
InChI=1S/C23H23NO4S/c25-19(11-6-17-7-12-21(26)22(27)14-17)10-5-16-3-8-18(9-4-16)24-23(28)15-20-2-1-13-29-20/h1-4,7-9,12-14,26-27H,5-6,10-11,15H2,(H,24,28)
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| InChIKey |
MYKJSMIEBBKJBR-UHFFFAOYSA-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