General Information of the Compound
| Compound ID |
CP0506984
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| Compound Name |
2-{5-[4,5-Bis-(4-methoxy-phenyl)-1H-imidazol-2-ylsulfanyl]-pentylsulfanyl}-1H-benzoimidazole
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| Structure |
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| Formula |
C29H30N4O2S2
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| Molecular Weight |
530.719
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| Canonical SMILES |
COc1ccc(cc1)-c1nc(SCCCCCSc2nc3ccccc3[nH]2)[nH]c1-c1ccc(OC)cc1
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| InChI |
InChI=1S/C29H30N4O2S2/c1-34-22-14-10-20(11-15-22)26-27(21-12-16-23(35-2)17-13-21)33-29(32-26)37-19-7-3-6-18-36-28-30-24-8-4-5-9-25(24)31-28/h4-5,8-17H,3,6-7,18-19H2,1-2H3,(H,30,31)(H,32,33)
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| InChIKey |
OXGSJCDBRAOSIS-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