General Information of the Compound
| Compound ID |
CP0486789
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| Compound Name |
1-[2-(3-methoxyphenyl)ethyl]pyrrolidine
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| Synonyms |
1-(3-methoxyphenethyl)pyrrolidine
3-(2-pyrrolidin-1-ylethyl)anisole
CHEMBL404911
JLMYWUJQHKXCOU-UHFFFAOYSA-N
SCHEMBL10669091
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| Structure |
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| Formula |
C13H19NO
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| Molecular Weight |
205.301
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| Canonical SMILES |
COc1cccc(CCN2CCCC2)c1
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| InChI |
InChI=1S/C13H19NO/c1-15-13-6-4-5-12(11-13)7-10-14-8-2-3-9-14/h4-6,11H,2-3,7-10H2,1H3
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| InChIKey |
JLMYWUJQHKXCOU-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