General Information of the Compound
| Compound ID |
CP0063319
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| Compound Name |
US9353093, 6
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| Structure |
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| Formula |
C23H17F3N4O2
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| Molecular Weight |
438.409
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| Canonical SMILES |
NC(=O)n1c(cc2ccccc12)-c1ccc(NC(=O)Nc2cccc(c2)C(F)(F)F)cc1
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| InChI |
InChI=1S/C23H17F3N4O2/c24-23(25,26)16-5-3-6-18(13-16)29-22(32)28-17-10-8-14(9-11-17)20-12-15-4-1-2-7-19(15)30(20)21(27)31/h1-13H,(H2,27,31)(H2,28,29,32)
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| InChIKey |
KWCIURFGWLVSPG-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