General Information of the Compound
| Compound ID |
CP0367697
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| Compound Name |
US9278960, 2-21
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| Structure |
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| Formula |
C22H18FN3O3
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| Molecular Weight |
391.402
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| Canonical SMILES |
NC(=O)c1cc(-c2ccc(F)cc2)c2ccc(CN3C(=O)CCCC3=O)cc2n1
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| InChI |
InChI=1S/C22H18FN3O3/c23-15-7-5-14(6-8-15)17-11-19(22(24)29)25-18-10-13(4-9-16(17)18)12-26-20(27)2-1-3-21(26)28/h4-11H,1-3,12H2,(H2,24,29)
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| InChIKey |
ROOSHFSVNCXONY-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