General Information of the Compound
| Compound ID |
CP0377383
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| Compound Name |
3-phenyl-1-(2-(8-(piperidin-1-yl)octyloxy)phenyl)propan-1-one
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| Structure |
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| Formula |
C28H39NO2
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| Molecular Weight |
421.625
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| Canonical SMILES |
O=C(CCc1ccccc1)c1ccccc1OCCCCCCCCN1CCCCC1
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| InChI |
InChI=1S/C28H39NO2/c30-27(20-19-25-15-7-5-8-16-25)26-17-9-10-18-28(26)31-24-14-4-2-1-3-11-21-29-22-12-6-13-23-29/h5,7-10,15-18H,1-4,6,11-14,19-24H2
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| InChIKey |
ZDWCABHCFJEQGX-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