General Information of the Compound
| Compound ID |
CP0218860
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| Compound Name |
(R)-6-(2-(2-methylpyrrolidin-1-yl)ethyl)-2-(pyridin-2-yl)quinoline
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| Structure |
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| Formula |
C21H23N3
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| Molecular Weight |
317.436
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| Canonical SMILES |
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1ccccn1
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| InChI |
InChI=1S/C21H23N3/c1-16-5-4-13-24(16)14-11-17-7-9-19-18(15-17)8-10-21(23-19)20-6-2-3-12-22-20/h2-3,6-10,12,15-16H,4-5,11,13-14H2,1H3/t16-/m1/s1
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| InChIKey |
LYWRKVXAAMHTBS-MRXNPFEDSA-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