General Information of the Compound
| Compound ID |
CP0508561
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| Compound Name |
2-[1-(benzenesulfonyl)-5-methoxy-2-methylindol-3-yl]-N,N-dimethylethanamine
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| Structure |
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| Formula |
C20H24N2O3S
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| Molecular Weight |
372.49
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| Canonical SMILES |
COc1ccc2n(c(C)c(CCN(C)C)c2c1)S(=O)(=O)c1ccccc1
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| InChI |
InChI=1S/C20H24N2O3S/c1-15-18(12-13-21(2)3)19-14-16(25-4)10-11-20(19)22(15)26(23,24)17-8-6-5-7-9-17/h5-11,14H,12-13H2,1-4H3
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| InChIKey |
DNOJEKLHKJAPCC-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