General Information of the Compound
| Compound ID |
CP0551855
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| Compound Name |
N-[[4-[(1-diethoxyphosphoryl-2,2-dimethylpropyl)amino]phenyl]methyl]-4-(trifluoromethoxy)benzamide
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| Structure |
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| Formula |
C24H32F3N2O5P
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| Molecular Weight |
516.497
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| Canonical SMILES |
CCOP(=O)(OCC)C(Nc1ccc(CNC(=O)c2ccc(OC(F)(F)F)cc2)cc1)C(C)(C)C
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| InChI |
InChI=1S/C24H32F3N2O5P/c1-6-32-35(31,33-7-2)22(23(3,4)5)29-19-12-8-17(9-13-19)16-28-21(30)18-10-14-20(15-11-18)34-24(25,26)27/h8-15,22,29H,6-7,16H2,1-5H3,(H,28,30)
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| InChIKey |
BLYBUMYPVTVMTG-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