General Information of the Compound
| Compound ID |
CP0213929
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| Compound Name |
3-(4-methoxyphenyl)-7-(4-piperidin-1-ylbutoxy)chromen-4-one
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| Structure |
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| Formula |
C25H29NO4
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| Molecular Weight |
407.51
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| Canonical SMILES |
COc1ccc(cc1)-c1coc2cc(OCCCCN3CCCCC3)ccc2c1=O
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| InChI |
InChI=1S/C25H29NO4/c1-28-20-9-7-19(8-10-20)23-18-30-24-17-21(11-12-22(24)25(23)27)29-16-6-5-15-26-13-3-2-4-14-26/h7-12,17-18H,2-6,13-16H2,1H3
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| InChIKey |
MXTJXSPHYQMIRK-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