General Information of the Compound
| Compound ID |
CP0555638
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| Compound Name |
phenyl-[4-(5-pyrrolidin-1-ylpentoxy)phenyl]methanone
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| Structure |
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| Formula |
C22H27NO2
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| Molecular Weight |
337.463
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| Canonical SMILES |
O=C(c1ccccc1)c1ccc(OCCCCCN2CCCC2)cc1
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| InChI |
InChI=1S/C22H27NO2/c24-22(19-9-3-1-4-10-19)20-11-13-21(14-12-20)25-18-8-2-5-15-23-16-6-7-17-23/h1,3-4,9-14H,2,5-8,15-18H2
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| InChIKey |
DWKZXEXTVBRZEL-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