General Information of the Compound
| Compound ID |
CP0499506
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| Compound Name |
1-Benzyl-1H-1,3,4b,9-tetraaza-fluorene-2,4-dione
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| Synonyms |
1-Benzyl-1H-1,3,4b,9-tetraaza-fluorene-2,4-dione
CHEMBL112256
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| Structure |
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| Formula |
C16H12N4O2
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| Molecular Weight |
292.298
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| Canonical SMILES |
O=c1[nH]c(=O)c2c(nc3ccccn23)n1Cc1ccccc1
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| InChI |
InChI=1S/C16H12N4O2/c21-15-13-14(17-12-8-4-5-9-19(12)13)20(16(22)18-15)10-11-6-2-1-3-7-11/h1-9H,10H2,(H,18,21,22)
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| InChIKey |
JHTRSVKUCQEETB-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
Clinical Information about the Compound