General Information of the Compound
| Compound ID |
CP0443060
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| Compound Name |
US9163015, 95
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| Structure |
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| Formula |
C12H7ClF2N4
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| Molecular Weight |
280.665
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| Canonical SMILES |
Fc1ccc2[nH]nc(Nc3ccc(F)c(Cl)c3)c2n1
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| InChI |
InChI=1S/C12H7ClF2N4/c13-7-5-6(1-2-8(7)14)16-12-11-9(18-19-12)3-4-10(15)17-11/h1-5H,(H2,16,18,19)
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| InChIKey |
OZYGIPXPFHTDTP-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