General Information of the Compound
| Compound ID |
CP0397846
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| Compound Name |
2-[5-methoxy-1-(4-methoxyphenyl)sulfonylindol-3-yl]-N,N-dimethylethanamine
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| Structure |
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| Formula |
C20H24N2O4S
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| Molecular Weight |
388.489
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| Canonical SMILES |
COc1ccc(cc1)S(=O)(=O)n1cc(CCN(C)C)c2cc(OC)ccc12
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| InChI |
InChI=1S/C20H24N2O4S/c1-21(2)12-11-15-14-22(20-10-7-17(26-4)13-19(15)20)27(23,24)18-8-5-16(25-3)6-9-18/h5-10,13-14H,11-12H2,1-4H3
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| InChIKey |
OJPTTYMYFMZMRB-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