General Information of the Compound
| Compound ID |
CP0877601
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| Compound Name |
1-(pyrrolidin-1-yl)-7-p-tolylheptan-1-one
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| Structure |
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| Formula |
C18H27NO
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| Molecular Weight |
273.42
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| Canonical SMILES |
Cc1ccc(CCCCCCC(=O)N2CCCC2)cc1
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| InChI |
InChI=1S/C18H27NO/c1-16-10-12-17(13-11-16)8-4-2-3-5-9-18(20)19-14-6-7-15-19/h10-13H,2-9,14-15H2,1H3
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| InChIKey |
ZZNHIEZGGNOKNS-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