General Information of the Compound
| Compound ID |
CP0474012
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| Compound Name |
[2-(2-hydroxypropan-2-yl)-2,3-dihydro-1-benzofuran-6-yl] 3,5-bis(phenylmethoxy)benzoate
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| Structure |
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| Formula |
C32H30O6
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| Molecular Weight |
510.586
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| Canonical SMILES |
CC(C)(O)C1Cc2ccc(OC(=O)c3cc(OCc4ccccc4)cc(OCc4ccccc4)c3)cc2O1
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| InChI |
InChI=1S/C32H30O6/c1-32(2,34)30-17-24-13-14-26(19-29(24)38-30)37-31(33)25-15-27(35-20-22-9-5-3-6-10-22)18-28(16-25)36-21-23-11-7-4-8-12-23/h3-16,18-19,30,34H,17,20-21H2,1-2H3
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| InChIKey |
XOLMGQFYSARTSD-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