General Information of the Compound
| Compound ID |
CP0521187
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| Compound Name |
5-(1-methoxyethyl)-1-methyl-9,10-dihydrophenanthrene-2,7-diol
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| Structure |
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| Formula |
C18H20O3
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| Molecular Weight |
284.355
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| Canonical SMILES |
COC(C)c1cc(O)cc2CCc3c(C)c(O)ccc3-c12
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| InChI |
InChI=1S/C18H20O3/c1-10-14-5-4-12-8-13(19)9-16(11(2)21-3)18(12)15(14)6-7-17(10)20/h6-9,11,19-20H,4-5H2,1-3H3
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| InChIKey |
GLKYZNQTRHKASO-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: PT02209, Organic anion transporter 3
Protein ID: PT04064, Solute carrier family 22 member 6