General Information of the Compound
| Compound ID |
CP0412539
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| Compound Name |
US9187424, 129
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| Structure |
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| Formula |
C30H26F6N2O3
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| Molecular Weight |
576.537
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| Canonical SMILES |
Cc1ccc(NC(=O)C2=C(CC(NC2=O)(c2ccc(OCCC(F)(F)F)cc2)C(F)(F)F)c2ccc(C)cc2)cc1
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| InChI |
InChI=1S/C30H26F6N2O3/c1-18-3-7-20(8-4-18)24-17-28(30(34,35)36,21-9-13-23(14-10-21)41-16-15-29(31,32)33)38-27(40)25(24)26(39)37-22-11-5-19(2)6-12-22/h3-14H,15-17H2,1-2H3,(H,37,39)(H,38,40)
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| InChIKey |
CUCGQOQOWCSWKK-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