General Information of the Compound
| Compound ID |
CP0534468
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| Compound Name |
9-{5-[4,5-Bis-(4-methoxy-phenyl)-1H-imidazol-2-ylsulfanyl]-pentyl}-9H-carbazole
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| Structure |
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| Formula |
C34H33N3O2S
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| Molecular Weight |
547.724
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| Canonical SMILES |
COc1ccc(cc1)-c1nc(SCCCCCn2c3ccccc3c3ccccc23)[nH]c1-c1ccc(OC)cc1
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| InChI |
InChI=1S/C34H33N3O2S/c1-38-26-18-14-24(15-19-26)32-33(25-16-20-27(39-2)21-17-25)36-34(35-32)40-23-9-3-8-22-37-30-12-6-4-10-28(30)29-11-5-7-13-31(29)37/h4-7,10-21H,3,8-9,22-23H2,1-2H3,(H,35,36)
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| InChIKey |
RSICLOUGVMQLBQ-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