General Information of the Compound
| Compound ID |
CP0488490
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| Compound Name |
1-(8-piperazin-1-ylquinolin-3-yl)pyrrolidin-2-one
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| Structure |
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| Formula |
C17H20N4O
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| Molecular Weight |
296.374
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| Canonical SMILES |
O=C1CCCN1c1cnc2c(cccc2c1)N1CCNCC1
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| InChI |
InChI=1S/C17H20N4O/c22-16-5-2-8-21(16)14-11-13-3-1-4-15(17(13)19-12-14)20-9-6-18-7-10-20/h1,3-4,11-12,18H,2,5-10H2
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| InChIKey |
BURUZPMDVDNJRH-UHFFFAOYSA-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