General Information of the Compound
| Compound ID |
CP0090824
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| Compound Name |
(R)-2-(4H-benzo[d][1,3]dioxin-6-yl)-6-(2-(2-methylpyrrolidin-1-yl)ethyl)quinoline
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| Structure |
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| Formula |
C24H26N2O2
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| Molecular Weight |
374.484
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| Canonical SMILES |
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1ccc2OCOCc2c1
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| InChI |
InChI=1S/C24H26N2O2/c1-17-3-2-11-26(17)12-10-18-4-7-22-19(13-18)5-8-23(25-22)20-6-9-24-21(14-20)15-27-16-28-24/h4-9,13-14,17H,2-3,10-12,15-16H2,1H3/t17-/m1/s1
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| InChIKey |
OWYPWYDPIBLTEG-QGZVFWFLSA-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