General Information of the Compound
| Compound ID |
CP0457817
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| Compound Name |
2-(2-acetylbenzimidazol-1-yl)-1-(4-chlorophenyl)ethanone
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| Structure |
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| Formula |
C17H13ClN2O2
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| Molecular Weight |
312.756
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| Canonical SMILES |
CC(=O)c1nc2ccccc2n1CC(=O)c1ccc(Cl)cc1
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| InChI |
InChI=1S/C17H13ClN2O2/c1-11(21)17-19-14-4-2-3-5-15(14)20(17)10-16(22)12-6-8-13(18)9-7-12/h2-9H,10H2,1H3
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| InChIKey |
AABPSESTZLBZAJ-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