General Information of the Compound
| Compound ID |
CP0510912
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| Compound Name |
2-[2-(2-methylphenoxy)ethylsulfanyl]-1H-benzimidazole
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| Structure |
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| Formula |
C16H16N2OS
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| Molecular Weight |
284.384
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| Canonical SMILES |
Cc1ccccc1OCCSc1nc2ccccc2[nH]1
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| InChI |
InChI=1S/C16H16N2OS/c1-12-6-2-5-9-15(12)19-10-11-20-16-17-13-7-3-4-8-14(13)18-16/h2-9H,10-11H2,1H3,(H,17,18)
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| InChIKey |
AAPVCQWLJSSUGW-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