General Information of the Compound
| Compound ID |
CP0510551
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| Compound Name |
2-(4-Chloro-phenoxymethyl)-4-methyl-1-(3-piperidin-4-yl-propyl)-1H-benzoimidazole
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| Structure |
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| Formula |
C23H28ClN3O
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| Molecular Weight |
397.95
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| Canonical SMILES |
Cc1cccc2n(CCCC3CCNCC3)c(COc3ccc(Cl)cc3)nc12
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| InChI |
InChI=1S/C23H28ClN3O/c1-17-4-2-6-21-23(17)26-22(16-28-20-9-7-19(24)8-10-20)27(21)15-3-5-18-11-13-25-14-12-18/h2,4,6-10,18,25H,3,5,11-16H2,1H3
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| InChIKey |
DEDJLZPXLMZMCJ-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