General Information of the Compound
| Compound ID |
CP0461245
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| Compound Name |
4-benzo[b]thiophen-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 |
C26H19F6N5S
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| Molecular Weight |
547.528
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| Canonical SMILES |
FC(F)(F)c1cc(-c2cc3ccccc3s2)c2nc([nH]c2c1)N1CCN(CC1)c1ncccc1C(F)(F)F
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| InChI |
InChI=1S/C26H19F6N5S/c27-25(28,29)16-13-17(21-12-15-4-1-2-6-20(15)38-21)22-19(14-16)34-24(35-22)37-10-8-36(9-11-37)23-18(26(30,31)32)5-3-7-33-23/h1-7,12-14H,8-11H2,(H,34,35)
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| InChIKey |
AQFJEFUFERVZLJ-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