General Information of the Compound
| Compound ID |
CP0524840
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| Compound Name |
5,5-dimethyl-1-((2-(4-methylpiperazin-1-yl)pyridin-4-yl)methyl)-3-(4-(trifluoromethylthio)phenyl)imidazolidine-2,4-dione
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| Structure |
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| Formula |
C23H26F3N5O2S
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| Molecular Weight |
493.555
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| Canonical SMILES |
CN1CCN(CC1)c1cc(CN2C(=O)N(C(=O)C2(C)C)c2ccc(SC(F)(F)F)cc2)ccn1
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| InChI |
InChI=1S/C23H26F3N5O2S/c1-22(2)20(32)31(17-4-6-18(7-5-17)34-23(24,25)26)21(33)30(22)15-16-8-9-27-19(14-16)29-12-10-28(3)11-13-29/h4-9,14H,10-13,15H2,1-3H3
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| InChIKey |
LPSFUUIFEVVEDP-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