General Information of the Compound
| Compound ID |
CP0457788
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| Compound Name |
1-[2-(4-methylphenyl)ethyl]pyrrolidine
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| Synonyms |
1-(2-p-tolyl-ethyl)-pyrrolidine
CHEMBL257912
SCHEMBL13164030
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| Structure |
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| Formula |
C13H19N
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| Molecular Weight |
189.302
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| Canonical SMILES |
Cc1ccc(CCN2CCCC2)cc1
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| InChI |
InChI=1S/C13H19N/c1-12-4-6-13(7-5-12)8-11-14-9-2-3-10-14/h4-7H,2-3,8-11H2,1H3
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| InChIKey |
RLADTPQRCGVXDS-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