General Information of the Compound
| Compound ID |
CP0489075
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| Compound Name |
2-[4-(4-methylpyridin-3-yl)benzimidazol-1-yl]acetonitrile
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| Structure |
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| Formula |
C15H12N4
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| Molecular Weight |
248.289
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| Canonical SMILES |
Cc1ccncc1-c1cccc2n(CC#N)cnc12
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| InChI |
InChI=1S/C15H12N4/c1-11-5-7-17-9-13(11)12-3-2-4-14-15(12)18-10-19(14)8-6-16/h2-5,7,9-10H,8H2,1H3
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| InChIKey |
LGIFLSIUYAIIAH-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