General Information of the Compound
| Compound ID |
CP0569385
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| Compound Name |
5-(2-quinolin-6-ylethyl)-1,4-dihydropyrazine-2,3-dione
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| Formula |
C15H13N3O2
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| Molecular Weight |
267.288
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| Canonical SMILES |
O=c1[nH]cc(CCc2ccc3ncccc3c2)[nH]c1=O
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| InChI |
InChI=1S/C15H13N3O2/c19-14-15(20)18-12(9-17-14)5-3-10-4-6-13-11(8-10)2-1-7-16-13/h1-2,4,6-9H,3,5H2,(H,17,19)(H,18,20)
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| InChIKey |
BPUPUNPLSNHPCK-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