General Information of the Compound
| Compound ID |
CP0002657
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| Compound Name |
2-Methyl-3-((S)-1-methyl-pyrrolidin-2-ylmethoxy)-pyridine
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| Structure |
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| Formula |
C12H18N2O
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| Molecular Weight |
206.289
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| Canonical SMILES |
CN1CCC[C@H]1COc1cccnc1C
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| InChI |
InChI=1S/C12H18N2O/c1-10-12(6-3-7-13-10)15-9-11-5-4-8-14(11)2/h3,6-7,11H,4-5,8-9H2,1-2H3/t11-/m0/s1
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| InChIKey |
RJVWDVTXZQWCCU-NSHDSACASA-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