General Information of the Compound
| Compound ID |
CP0146700
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| Compound Name |
2-chloro-6-fluoro-N-[4-(1-methyl-5-propan-2-ylpyrazol-4-yl)-2-(2,2,2-trifluoroethoxy)phenyl]-N-(trideuteriomethyl)benzamide
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| Structure |
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| Formula |
C23H22ClF4N3O2
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| Molecular Weight |
483.893
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| Canonical SMILES |
CC(C)c1c(cnn1C)-c1ccc(N(C)C(=O)c2c(F)cccc2Cl)c(OCC(F)(F)F)c1
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| InChI |
InChI=1S/C23H22ClF4N3O2/c1-13(2)21-15(11-29-31(21)4)14-8-9-18(19(10-14)33-12-23(26,27)28)30(3)22(32)20-16(24)6-5-7-17(20)25/h5-11,13H,12H2,1-4H3/i3D3
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| InChIKey |
ZZHULZAEOZXKFZ-HPRDVNIFSA-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