General Information of the Compound
| Compound ID |
CP0276940
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| Compound Name |
3'-tert-Butyl-5'-hydroxy-biphenyl-4-carboxylic acid
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| Structure |
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| Formula |
C17H18O3
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| Molecular Weight |
270.328
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| Canonical SMILES |
CC(C)(C)c1cc(O)cc(c1)-c1ccc(cc1)C(O)=O
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| InChI |
InChI=1S/C17H18O3/c1-17(2,3)14-8-13(9-15(18)10-14)11-4-6-12(7-5-11)16(19)20/h4-10,18H,1-3H3,(H,19,20)
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| InChIKey |
QDGQQGJWBKYSPU-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