General Information of the Compound
| Compound ID |
CP0489792
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| Compound Name |
3-phenyl-1-(2-(7-(piperidin-1-yl)heptyloxy)phenyl)propan-1-one
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| Structure |
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| Formula |
C27H37NO2
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| Molecular Weight |
407.598
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| Canonical SMILES |
O=C(CCc1ccccc1)c1ccccc1OCCCCCCCN1CCCCC1
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| InChI |
InChI=1S/C27H37NO2/c29-26(19-18-24-14-6-4-7-15-24)25-16-8-9-17-27(25)30-23-13-3-1-2-10-20-28-21-11-5-12-22-28/h4,6-9,14-17H,1-3,5,10-13,18-23H2
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| InChIKey |
CFJGQDRBFABZBD-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