General Information of the Compound
| Compound ID |
CP0565536
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| Compound Name |
1,2,3,4,5-pentafluoro-6-[(E)-2-nitroethenyl]benzene
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| Structure |
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| Formula |
C8H2F5NO2
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| Molecular Weight |
239.099
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| Canonical SMILES |
[O-][N+](=O)\C=C\c1c(F)c(F)c(F)c(F)c1F
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| InChI |
InChI=1S/C8H2F5NO2/c9-4-3(1-2-14(15)16)5(10)7(12)8(13)6(4)11/h1-2H/b2-1+
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| InChIKey |
LBBACRWAXVCTNR-OWOJBTEDSA-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