General Information of the Compound
| Compound ID |
CP0157712
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| Compound Name |
7-(4-piperidin-1-ylbutoxy)-3-[4-(2-piperidin-1-ylethoxy)phenyl]chromen-4-one
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| Structure |
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| Formula |
C31H40N2O4
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| Molecular Weight |
504.671
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| Canonical SMILES |
O=c1c(coc2cc(OCCCCN3CCCCC3)ccc12)-c1ccc(OCCN2CCCCC2)cc1
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| InChI |
InChI=1S/C31H40N2O4/c34-31-28-14-13-27(35-21-8-7-19-32-15-3-1-4-16-32)23-30(28)37-24-29(31)25-9-11-26(12-10-25)36-22-20-33-17-5-2-6-18-33/h9-14,23-24H,1-8,15-22H2
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| InChIKey |
FMVIQDVJIXWGIQ-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