General Information of the Compound
| Compound ID |
CP0451809
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| Compound Name |
4-thiazol-2-yl-6-(trifluoromethyl)-2-(4-(3-(trifluoromethyl)-pyridin-2-yl)piperazin-1-yl)-1H-benzo[d]imidazole
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| Structure |
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| Formula |
C21H16F6N6S
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| Molecular Weight |
498.456
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| Canonical SMILES |
FC(F)(F)c1cc(-c2nccs2)c2nc([nH]c2c1)N1CCN(CC1)c1ncccc1C(F)(F)F
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| InChI |
InChI=1S/C21H16F6N6S/c22-20(23,24)12-10-13(18-29-4-9-34-18)16-15(11-12)30-19(31-16)33-7-5-32(6-8-33)17-14(21(25,26)27)2-1-3-28-17/h1-4,9-11H,5-8H2,(H,30,31)
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| InChIKey |
XCNFCMREGLGKMX-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