General Information of the Compound
| Compound ID |
CP0899427
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| Compound Name |
US8993765, 9
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| Structure |
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| Formula |
C24H20F3N5O2
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| Molecular Weight |
467.451
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| Canonical SMILES |
CC(=O)N1CCc2c(c3ccc(-n4ccc(-c5ccc(C(F)(F)F)nc5)cc4=O)nc3n2C)C1
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| InChI |
InChI=1S/C24H20F3N5O2/c1-14(33)31-9-8-19-18(13-31)17-4-6-21(29-23(17)30(19)2)32-10-7-15(11-22(32)34)16-3-5-20(28-12-16)24(25,26)27/h3-7,10-12H,8-9,13H2,1-2H3
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| InChIKey |
WPGBYOJCZFWBTA-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