General Information of the Compound
| Compound ID |
CP0372060
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| Compound Name |
6-chloro-2-[4-(3-trifluoromethylpyridin-2-yl)piperazin-1-yl]-1H-benzo[d]imidazole
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| Structure |
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| Formula |
C17H15ClF3N5
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| Molecular Weight |
381.789
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| Canonical SMILES |
FC(F)(F)c1cccnc1N1CCN(CC1)c1nc2ccc(Cl)cc2[nH]1
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| InChI |
InChI=1S/C17H15ClF3N5/c18-11-3-4-13-14(10-11)24-16(23-13)26-8-6-25(7-9-26)15-12(17(19,20)21)2-1-5-22-15/h1-5,10H,6-9H2,(H,23,24)
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| InChIKey |
WRZHZDCUKDBJFE-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