General Information of the Compound
| Compound ID |
CP0382233
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| Compound Name |
(2S)-1-[2-(3-methoxyphenyl)ethyl]-2-methylpyrrolidine
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| Synonyms |
(S)-1-(3-methoxyphenethyl)-2-methylpyrrolidine
CHEMBL272306
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| Structure |
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| Formula |
C14H21NO
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| Molecular Weight |
219.328
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| Canonical SMILES |
COc1cccc(CCN2CCC[C@@H]2C)c1
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| InChI |
InChI=1S/C14H21NO/c1-12-5-4-9-15(12)10-8-13-6-3-7-14(11-13)16-2/h3,6-7,11-12H,4-5,8-10H2,1-2H3/t12-/m0/s1
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| InChIKey |
INKHQVYBVMGBHD-LBPRGKRZSA-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