General Information of the Compound
| Compound ID |
CP0479226
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| Compound Name |
US9163015, 62
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| Structure |
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| Formula |
C13H8F4N4
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| Molecular Weight |
296.227
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| Canonical SMILES |
Fc1cc(Nc2n[nH]c3cccnc23)cc(c1)C(F)(F)F
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| InChI |
InChI=1S/C13H8F4N4/c14-8-4-7(13(15,16)17)5-9(6-8)19-12-11-10(20-21-12)2-1-3-18-11/h1-6H,(H2,19,20,21)
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| InChIKey |
WXNUDKBDIVACCS-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