General Information of the Compound
| Compound ID |
CP0439179
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| Compound Name |
N-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]-4-cyanobenzamide
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| Structure |
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| Formula |
C21H13ClN4O
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| Molecular Weight |
372.815
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| Canonical SMILES |
Clc1ccc(NC(=O)c2ccc(cc2)C#N)cc1-c1nc2ccccc2[nH]1
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| InChI |
InChI=1S/C21H13ClN4O/c22-17-10-9-15(24-21(27)14-7-5-13(12-23)6-8-14)11-16(17)20-25-18-3-1-2-4-19(18)26-20/h1-11H,(H,24,27)(H,25,26)
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| InChIKey |
MQCQYXOFWXZJOA-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