General Information of the Compound
| Compound ID |
CP0288171
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| Compound Name |
[5-(3-ethyl-4-hydroxyphenyl)thiophen-2-yl]-(3-hydroxyphenyl)methanone
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| Structure |
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| Formula |
C19H16O3S
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| Molecular Weight |
324.401
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| Canonical SMILES |
CCc1cc(ccc1O)-c1ccc(s1)C(=O)c1cccc(O)c1
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| InChI |
InChI=1S/C19H16O3S/c1-2-12-10-13(6-7-16(12)21)17-8-9-18(23-17)19(22)14-4-3-5-15(20)11-14/h3-11,20-21H,2H2,1H3
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| InChIKey |
VKLRIPXITOKYKX-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