General Information of the Compound
| Compound ID |
CP0120793
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| Compound Name |
2-(4-fluorophenyl)-3-(4-hydroxyphenoxy)-1-benzothiophen-6-ol
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| Structure |
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| Formula |
C20H13FO3S
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| Molecular Weight |
352.386
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| Canonical SMILES |
Oc1ccc(Oc2c(sc3cc(O)ccc23)-c2ccc(F)cc2)cc1
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| InChI |
InChI=1S/C20H13FO3S/c21-13-3-1-12(2-4-13)20-19(24-16-8-5-14(22)6-9-16)17-10-7-15(23)11-18(17)25-20/h1-11,22-23H
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| InChIKey |
MCTBDHKWASVVRV-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