General Information of the Compound
| Compound ID |
CP0354805
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| Compound Name |
2-(1-benzylpiperidin-4-yl)ethyl 6,7-dimethoxy-4-oxochromene-2-carboxylate
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| Structure |
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| Formula |
C26H29NO6
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| Molecular Weight |
451.519
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| Canonical SMILES |
COc1cc2oc(cc(=O)c2cc1OC)C(=O)OCCC1CCN(Cc2ccccc2)CC1
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| InChI |
InChI=1S/C26H29NO6/c1-30-23-14-20-21(28)15-25(33-22(20)16-24(23)31-2)26(29)32-13-10-18-8-11-27(12-9-18)17-19-6-4-3-5-7-19/h3-7,14-16,18H,8-13,17H2,1-2H3
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| InChIKey |
CZMZUNUZUGWCRN-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