General Information of the Compound
| Compound ID |
CP0406302
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| Compound Name |
2-[3-[2-[(4-butoxyphenyl)sulfonylamino]ethyl]indol-1-yl]-N-(4-methoxyphenyl)acetamide
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| Structure |
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| Formula |
C29H33N3O5S
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| Molecular Weight |
535.666
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| Canonical SMILES |
CCCCOc1ccc(cc1)S(=O)(=O)NCCc1cn(CC(=O)Nc2ccc(OC)cc2)c2ccccc12
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| InChI |
InChI=1S/C29H33N3O5S/c1-3-4-19-37-25-13-15-26(16-14-25)38(34,35)30-18-17-22-20-32(28-8-6-5-7-27(22)28)21-29(33)31-23-9-11-24(36-2)12-10-23/h5-16,20,30H,3-4,17-19,21H2,1-2H3,(H,31,33)
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| InChIKey |
KKOVFLLJOGLPHQ-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