General Information of the Compound
| Compound ID |
CP0696866
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| Compound Name |
(+/-)-2-((2-Oxo-2H-chromen-7-yl)oxy)ethyl 2-(4-Isobutylphenyl)propanoate
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| Structure |
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| Formula |
C24H26O5
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| Molecular Weight |
394.467
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| Canonical SMILES |
CC(C)Cc1ccc(C(C)C(=O)OCCOc2ccc3ccc(=O)oc3c2)cc1
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| InChI |
InChI=1S/C24H26O5/c1-16(2)14-18-4-6-19(7-5-18)17(3)24(26)28-13-12-27-21-10-8-20-9-11-23(25)29-22(20)15-21/h4-11,15-17H,12-14H2,1-3H3
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| InChIKey |
KOSHHJSLDGOFFM-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