General Information of the Compound
| Compound ID |
CP0179579
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| Compound Name |
1-[2-(2-Benzyl-phenoxy)-ethyl]-pyrrolidine
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| Synonyms |
1-[2-(2-Benzyl-phenoxy)-ethyl]-pyrrolidine
BDBM50151045
CHEMBL435505
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| Structure |
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| Formula |
C19H23NO
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| Molecular Weight |
281.399
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| Canonical SMILES |
C(CN1CCCC1)Oc1ccccc1Cc1ccccc1
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| InChI |
InChI=1S/C19H23NO/c1-2-8-17(9-3-1)16-18-10-4-5-11-19(18)21-15-14-20-12-6-7-13-20/h1-5,8-11H,6-7,12-16H2
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| InChIKey |
MNZXCYDDVWTITD-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
Clinical Information about the Compound