General Information of the Compound
| Compound ID |
CP0266720
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| Compound Name |
6-methyl-2-[4-[6-(3-methylpiperidin-1-yl)hexoxy]phenyl]chromen-4-one
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| Structure |
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| Formula |
C28H35NO3
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| Molecular Weight |
433.592
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| Canonical SMILES |
CC1CCCN(CCCCCCOc2ccc(cc2)-c2cc(=O)c3cc(C)ccc3o2)C1
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| InChI |
InChI=1S/C28H35NO3/c1-21-9-14-27-25(18-21)26(30)19-28(32-27)23-10-12-24(13-11-23)31-17-6-4-3-5-15-29-16-7-8-22(2)20-29/h9-14,18-19,22H,3-8,15-17,20H2,1-2H3
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| InChIKey |
JYRHSSRVHVHKHL-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