General Information of the Compound
| Compound ID |
CP0518713
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| Compound Name |
benzyl 1-acetyl-2-ethylpyrrolidine-2-carboxylate
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| Structure |
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| Formula |
C16H21NO3
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| Molecular Weight |
275.348
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| Canonical SMILES |
CCC1(CCCN1C(C)=O)C(=O)OCc1ccccc1
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| InChI |
InChI=1S/C16H21NO3/c1-3-16(10-7-11-17(16)13(2)18)15(19)20-12-14-8-5-4-6-9-14/h4-6,8-9H,3,7,10-12H2,1-2H3
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| InChIKey |
ZOTQTAOTOGOBHL-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