General Information of the Compound
| Compound ID |
CP0457792
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| Compound Name |
4-[2-[(2S)-2-methylpyrrolidin-1-yl]ethyl]pyridine
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| Synonyms |
(S)-4-(2-(2-methylpyrrolidin-1-yl)ethyl)pyridine
CHEMBL405069
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| Structure |
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| Formula |
C12H18N2
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| Molecular Weight |
190.29
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| Canonical SMILES |
C[C@H]1CCCN1CCc1ccncc1
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| InChI |
InChI=1S/C12H18N2/c1-11-3-2-9-14(11)10-6-12-4-7-13-8-5-12/h4-5,7-8,11H,2-3,6,9-10H2,1H3/t11-/m0/s1
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| InChIKey |
HTPLEJUDOQHUSX-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
Clinical Information about the Compound