General Information of the Compound
| Compound ID |
CP0474231
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| Compound Name |
2-((6-chlorobenzo[d][1,3]dioxol-5-yloxy)methyl)-6-methoxy-1H-benzo[d]imidazole
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| Structure |
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| Formula |
C16H13ClN2O4
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| Molecular Weight |
332.743
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| Canonical SMILES |
COc1ccc2nc(COc3cc4OCOc4cc3Cl)[nH]c2c1
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| InChI |
InChI=1S/C16H13ClN2O4/c1-20-9-2-3-11-12(4-9)19-16(18-11)7-21-13-6-15-14(5-10(13)17)22-8-23-15/h2-6H,7-8H2,1H3,(H,18,19)
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| InChIKey |
KSUFSTNNCAPUMT-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