General Information of the Compound
| Compound ID |
CP0958639
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| Compound Name |
1-(2,6-dimethylphenyl)-3-ethyl-5-oxo-N-(3-(trifluoromethyl)phenyl)pyrrolidine-3-carboxamide
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| Structure |
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| Formula |
C22H23F3N2O2
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| Molecular Weight |
404.432
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| Canonical SMILES |
CCC1(C(=O)Nc2cccc(C(F)(F)F)c2)CC(=O)N(c2c(C)cccc2C)C1
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| InChI |
InChI=1S/C22H23F3N2O2/c1-4-21(20(29)26-17-10-6-9-16(11-17)22(23,24)25)12-18(28)27(13-21)19-14(2)7-5-8-15(19)3/h5-11H,4,12-13H2,1-3H3,(H,26,29)
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| InChIKey |
KMNLMINWSNSBQP-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