General Information of the Compound
| Compound ID |
CP0859092
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| Compound Name |
US9200001, 54
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| Structure |
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| Formula |
C19H17F2N7
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| Molecular Weight |
381.39
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| Canonical SMILES |
Cc1nc(C2CC2c2nc3cc(F)c(F)cc3[nH]2)cc(-n2nc(C)nc2C)n1
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| InChI |
InChI=1S/C19H17F2N7/c1-8-23-15(7-18(24-8)28-10(3)22-9(2)27-28)11-4-12(11)19-25-16-5-13(20)14(21)6-17(16)26-19/h5-7,11-12H,4H2,1-3H3,(H,25,26)
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| InChIKey |
MTCUVANHCYZQST-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