General Information of the Compound
| Compound ID |
CP0188386
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| Compound Name |
3-fluoro-4-[4-(2-fluoro-4-hydroxyphenyl)thiophen-3-yl]phenol
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| Structure |
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| Formula |
C16H10F2O2S
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| Molecular Weight |
304.317
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| Canonical SMILES |
Oc1ccc(-c2cscc2-c2ccc(O)cc2F)c(F)c1
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| InChI |
InChI=1S/C16H10F2O2S/c17-15-5-9(19)1-3-11(15)13-7-21-8-14(13)12-4-2-10(20)6-16(12)18/h1-8,19-20H
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| InChIKey |
APIVWORSVXKTBM-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
Protein ID: PT00886, Estrogen receptor
Protein ID: PT00889, Estrogen receptor beta