General Information of the Compound
| Compound ID |
CP0532410
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| Compound Name |
US8853242, 6
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| Structure |
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| Formula |
C18H13F3N4O
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| Molecular Weight |
358.323
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| Canonical SMILES |
Cc1cc(-c2c(F)cc(F)cc2F)c2cc(ccc2n1)C(=O)N=C(N)N
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| InChI |
InChI=1S/C18H13F3N4O/c1-8-4-12(16-13(20)6-10(19)7-14(16)21)11-5-9(2-3-15(11)24-8)17(26)25-18(22)23/h2-7H,1H3,(H4,22,23,25,26)
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| InChIKey |
DZAUWILXMWFUQY-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