General Information of the Compound
Compound ID |
CP0862413
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Compound Name |
N-(3,5-bis(trifluoromethyl)phenyl)-3-isopropyl-5-oxo-1-(2-vinylphenyl)pyrrolidine-3-carboxamide
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Structure |
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Formula |
C24H22F6N2O2
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Molecular Weight |
484.44
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Canonical SMILES |
C=Cc1ccccc1N1CC(C(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(C(C)C)CC1=O
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InChI |
InChI=1S/C24H22F6N2O2/c1-4-15-7-5-6-8-19(15)32-13-22(14(2)3,12-20(32)33)21(34)31-18-10-16(23(25,26)27)9-17(11-18)24(28,29)30/h4-11,14H,1,12-13H2,2-3H3,(H,31,34)
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InChIKey |
DQHQCWRLOWJDNQ-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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