General Information of the Compound
| Compound ID |
CP0464343
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| Compound Name |
2-(4-(3-(trifluoromethyl)pyridin-2-yl)piperazin-1-yl)-3H-benzo[d]imidazole-5-carbonitrile
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| Structure |
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| Formula |
C18H15F3N6
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| Molecular Weight |
372.354
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| Canonical SMILES |
FC(F)(F)c1cccnc1N1CCN(CC1)c1nc2ccc(cc2[nH]1)C#N
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| InChI |
InChI=1S/C18H15F3N6/c19-18(20,21)13-2-1-5-23-16(13)26-6-8-27(9-7-26)17-24-14-4-3-12(11-22)10-15(14)25-17/h1-5,10H,6-9H2,(H,24,25)
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| InChIKey |
SXUBSOIAZWRURN-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