General Information of the Compound
| Compound ID |
CP0568992
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| Compound Name |
N-[[5-tert-butyl-2-(3-chlorophenyl)pyrazol-3-yl]methyl]-2-[4-fluoro-3-(trifluoromethyl)phenyl]propanamide
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| Formula |
C24H24ClF4N3O
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| Molecular Weight |
481.921
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| Canonical SMILES |
CC(C(=O)NCc1cc(nn1-c1cccc(Cl)c1)C(C)(C)C)c1ccc(F)c(c1)C(F)(F)F
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| InChI |
InChI=1S/C24H24ClF4N3O/c1-14(15-8-9-20(26)19(10-15)24(27,28)29)22(33)30-13-18-12-21(23(2,3)4)31-32(18)17-7-5-6-16(25)11-17/h5-12,14H,13H2,1-4H3,(H,30,33)
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| InChIKey |
MVFFNEPGXHEWJT-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