General Information of the Compound
| Compound ID |
CP0280646
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| Compound Name |
US10806720, Compound 1029
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| Structure |
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| Formula |
C14H10F4N4O
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| Molecular Weight |
326.253
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| Canonical SMILES |
Fc1cnn(CCC(=O)Nc2ccc(C#N)c(c2)C(F)(F)F)c1
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| InChI |
InChI=1S/C14H10F4N4O/c15-10-7-20-22(8-10)4-3-13(23)21-11-2-1-9(6-19)12(5-11)14(16,17)18/h1-2,5,7-8H,3-4H2,(H,21,23)
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| InChIKey |
FKCFLBHEJXAVNN-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