General Information of the Compound
| Compound ID |
CP0353644
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| Compound Name |
7-(2-piperidin-1-ylethoxy)-3-[4-(2-piperidin-1-ylethoxy)phenyl]chromen-4-one
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| Structure |
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| Formula |
C29H36N2O4
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| Molecular Weight |
476.617
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| Canonical SMILES |
O=c1c(coc2cc(OCCN3CCCCC3)ccc12)-c1ccc(OCCN2CCCCC2)cc1
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| InChI |
InChI=1S/C29H36N2O4/c32-29-26-12-11-25(34-20-18-31-15-5-2-6-16-31)21-28(26)35-22-27(29)23-7-9-24(10-8-23)33-19-17-30-13-3-1-4-14-30/h7-12,21-22H,1-6,13-20H2
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| InChIKey |
RVODBMMZZGFRMJ-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