General Information of the Compound
| Compound ID |
CP0492680
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| Compound Name |
2-(3,4-difluorobenzylthio)-6-methoxy-1H-benzo[d]imidazole
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| Structure |
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| Formula |
C15H12F2N2OS
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| Molecular Weight |
306.337
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| Canonical SMILES |
COc1ccc2nc(SCc3ccc(F)c(F)c3)[nH]c2c1
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| InChI |
InChI=1S/C15H12F2N2OS/c1-20-10-3-5-13-14(7-10)19-15(18-13)21-8-9-2-4-11(16)12(17)6-9/h2-7H,8H2,1H3,(H,18,19)
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| InChIKey |
VIMVBNSBMXZSMJ-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