General Information of the Compound
| Compound ID |
CP0780882
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| Compound Name |
(+/-)-4-[4-Hydroxymethyl-4-(4-methoxy-phenyl)-3-methyl-2,5-dioxo-imidazolidin-1-yl]-2-trifluoromethyl-benzonitrile
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| Structure |
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| Formula |
C20H16F3N3O4
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| Molecular Weight |
419.359
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| Canonical SMILES |
COc1ccc(C2(CO)C(=O)N(c3ccc(C#N)c(C(F)(F)F)c3)C(=O)N2C)cc1
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| InChI |
InChI=1S/C20H16F3N3O4/c1-25-18(29)26(14-6-3-12(10-24)16(9-14)20(21,22)23)17(28)19(25,11-27)13-4-7-15(30-2)8-5-13/h3-9,27H,11H2,1-2H3
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| InChIKey |
IRDRROXMWMWUSU-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