General Information of the Compound
| Compound ID |
CP0421140
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| Compound Name |
1-Benzyl-7-tert-butyl-1H-1,3,4b,9-tetraaza-fluorene-2,4-dione
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| Structure |
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| Formula |
C20H20N4O2
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| Molecular Weight |
348.406
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| Canonical SMILES |
CC(C)(C)c1ccn2c(c1)nc1n(Cc3ccccc3)c(=O)[nH]c(=O)c21
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| InChI |
InChI=1S/C20H20N4O2/c1-20(2,3)14-9-10-23-15(11-14)21-17-16(23)18(25)22-19(26)24(17)12-13-7-5-4-6-8-13/h4-11H,12H2,1-3H3,(H,22,25,26)
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| InChIKey |
OKOSYWZSCFVGIP-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