General Information of the Compound
| Compound ID |
CP0129115
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| Compound Name |
1,2-Bis-(4-hydroxy-phenyl)-ethane
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| Structure |
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| Formula |
C14H14O2
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| Molecular Weight |
214.264
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| Canonical SMILES |
Oc1ccc(CCc2ccc(O)cc2)cc1
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| InChI |
InChI=1S/C14H14O2/c15-13-7-3-11(4-8-13)1-2-12-5-9-14(16)10-6-12/h3-10,15-16H,1-2H2
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| InChIKey |
URFNSYWAGGETFK-UHFFFAOYSA-N
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| CAS |
6052-84-2
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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