General Information of the Compound
| Compound ID |
CP0514975
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| Compound Name |
2-[4-(4-fluoro-3-methylphenyl)-2-(4-fluorophenyl)imidazol-1-yl]-1-(2-methyl-4,6-dihydropyrrolo[3,4-d][1,3]thiazol-5-yl)ethanone
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| Structure |
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| Formula |
C24H20F2N4OS
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| Molecular Weight |
450.514
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| Canonical SMILES |
Cc1nc2CN(Cc2s1)C(=O)Cn1cc(nc1-c1ccc(F)cc1)-c1ccc(F)c(C)c1
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| InChI |
InChI=1S/C24H20F2N4OS/c1-14-9-17(5-8-19(14)26)20-10-30(24(28-20)16-3-6-18(25)7-4-16)13-23(31)29-11-21-22(12-29)32-15(2)27-21/h3-10H,11-13H2,1-2H3
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| InChIKey |
HWPJTSREUYQZNO-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