General Information of the Compound
| Compound ID |
CP0532014
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| Compound Name |
6-methoxy-2-(pyridin-4-ylmethylthio)-1H-benzo[d]imidazole
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| Structure |
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| Formula |
C14H13N3OS
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| Molecular Weight |
271.345
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| Canonical SMILES |
COc1ccc2nc(SCc3ccncc3)[nH]c2c1
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| InChI |
InChI=1S/C14H13N3OS/c1-18-11-2-3-12-13(8-11)17-14(16-12)19-9-10-4-6-15-7-5-10/h2-8H,9H2,1H3,(H,16,17)
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| InChIKey |
ITQRPLZARFVXSU-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