General Information of the Compound
| Compound ID |
CP0515649
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| Compound Name |
(1-Benzenesulfonyl-5-methoxy-1H-indol-3-ylmethyl)-dimethyl-amine
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| Structure |
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| Formula |
C18H20N2O3S
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| Molecular Weight |
344.436
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| Canonical SMILES |
COc1ccc2n(cc(CN(C)C)c2c1)S(=O)(=O)c1ccccc1
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| InChI |
InChI=1S/C18H20N2O3S/c1-19(2)12-14-13-20(18-10-9-15(23-3)11-17(14)18)24(21,22)16-7-5-4-6-8-16/h4-11,13H,12H2,1-3H3
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| InChIKey |
GNKMXLHOOLZFRA-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