General Information of the Compound
| Compound ID |
CP0516273
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| Compound Name |
US9163015, 10
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| Structure |
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| Formula |
C14H12F2N4O2
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| Molecular Weight |
306.272
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| Canonical SMILES |
COc1ccc(Nc2n[nH]c3cccnc23)cc1OC(F)F
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| InChI |
InChI=1S/C14H12F2N4O2/c1-21-10-5-4-8(7-11(10)22-14(15)16)18-13-12-9(19-20-13)3-2-6-17-12/h2-7,14H,1H3,(H2,18,19,20)
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| InChIKey |
CMXBVWMFNJBRCT-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