General Information of the Compound
| Compound ID |
CP0524841
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| Compound Name |
1-((2-(benzylamino)pyridin-4-yl)methyl)-5,5-dimethyl-3-(4-(trifluoromethylthio)phenyl)imidazolidine-2,4-dione
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| Structure |
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| Formula |
C25H23F3N4O2S
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| Molecular Weight |
500.546
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| Canonical SMILES |
CC1(C)N(Cc2ccnc(NCc3ccccc3)c2)C(=O)N(C1=O)c1ccc(SC(F)(F)F)cc1
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| InChI |
InChI=1S/C25H23F3N4O2S/c1-24(2)22(33)32(19-8-10-20(11-9-19)35-25(26,27)28)23(34)31(24)16-18-12-13-29-21(14-18)30-15-17-6-4-3-5-7-17/h3-14H,15-16H2,1-2H3,(H,29,30)
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| InChIKey |
VQOBYAUGMNOJKG-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