General Information of the Compound
| Compound ID |
CP0400398
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| Compound Name |
2,7-naphthyridine-1,3,6,8-tetrone
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| Structure |
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| Formula |
C8H8N2O4
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| Molecular Weight |
196.162
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| Canonical SMILES |
O=C1CC2CC(=O)NC(=O)C2C(=O)N1
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| InChI |
InChI=1S/C8H8N2O4/c11-4-1-3-2-5(12)10-8(14)6(3)7(13)9-4/h3,6H,1-2H2,(H,9,11,13)(H,10,12,14)
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| InChIKey |
NTUBFLKJMMWXNI-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