General Information of the Compound
| Compound ID |
CP0502023
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| Compound Name |
1-[2-(2,4,6-trimethylphenyl)ethyl]pyrrolidine
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| Synonyms |
1-[2-(2,4,6-trimethyl-phenyl)-ethyl]-pyrrolidine
CHEMBL272140
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| Structure |
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| Formula |
C15H23N
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| Molecular Weight |
217.356
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| Canonical SMILES |
Cc1cc(C)c(CCN2CCCC2)c(C)c1
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| InChI |
InChI=1S/C15H23N/c1-12-10-13(2)15(14(3)11-12)6-9-16-7-4-5-8-16/h10-11H,4-9H2,1-3H3
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| InChIKey |
IYOUBSBBWJSRIG-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