General Information of the Compound
| Compound ID |
CP0842955
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| Compound Name |
rac-4-[3,4-dimethyl-2,5-dioxo-4-(4-hydroxyphenyl)imidazolidin-1-yl]-3-methyl-2-trifluoromethylbenzonitrile
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| Structure |
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| Formula |
C20H16F3N3O3
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| Molecular Weight |
403.36
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| Canonical SMILES |
Cc1c(N2C(=O)N(C)C(C)(c3ccc(O)cc3)C2=O)ccc(C#N)c1C(F)(F)F
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| InChI |
InChI=1S/C20H16F3N3O3/c1-11-15(9-4-12(10-24)16(11)20(21,22)23)26-17(28)19(2,25(3)18(26)29)13-5-7-14(27)8-6-13/h4-9,27H,1-3H3
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| InChIKey |
CPLRYMDYZRBOAA-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