General Information of the Compound
| Compound ID |
CP0407370
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| Compound Name |
US9187424, 5
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| Structure |
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| Formula |
C24H23F3N2O2
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| Molecular Weight |
428.454
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| Canonical SMILES |
CCCCOc1ccc(cc1)C1(CC(=C(C#N)C(=O)N1)c1ccc(C)cc1)C(F)(F)F
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| InChI |
InChI=1S/C24H23F3N2O2/c1-3-4-13-31-19-11-9-18(10-12-19)23(24(25,26)27)14-20(21(15-28)22(30)29-23)17-7-5-16(2)6-8-17/h5-12H,3-4,13-14H2,1-2H3,(H,29,30)
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| InChIKey |
WZFMNKQUHNEMQA-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