General Information of the Compound
| Compound ID |
CP0126643
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| Compound Name |
(R)-6-(2-(2-methylpyrrolidin-1-yl)ethyl)-2-(4-(piperidin-1-yl)phenyl)quinoline
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| Structure |
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| Formula |
C27H33N3
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| Molecular Weight |
399.582
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| Canonical SMILES |
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1ccc(cc1)N1CCCCC1
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| InChI |
InChI=1S/C27H33N3/c1-21-6-5-18-29(21)19-15-22-7-13-27-24(20-22)10-14-26(28-27)23-8-11-25(12-9-23)30-16-3-2-4-17-30/h7-14,20-21H,2-6,15-19H2,1H3/t21-/m1/s1
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| InChIKey |
ZKIWXUBGHCOMER-OAQYLSRUSA-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