General Information of the Compound
| Compound ID |
CP0511635
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| Compound Name |
1-[9-(2,5-dimethoxyphenyl)sulfonyl-6-methoxy-1,2,3,4-tetrahydrocarbazol-4-yl]-N,N-dimethylmethanamine
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| Structure |
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| Formula |
C24H30N2O5S
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| Molecular Weight |
458.58
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| Canonical SMILES |
COc1ccc(OC)c(c1)S(=O)(=O)n1c2CCCC(CN(C)C)c2c2cc(OC)ccc12
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| InChI |
InChI=1S/C24H30N2O5S/c1-25(2)15-16-7-6-8-21-24(16)19-13-17(29-3)9-11-20(19)26(21)32(27,28)23-14-18(30-4)10-12-22(23)31-5/h9-14,16H,6-8,15H2,1-5H3
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| InChIKey |
FMMHFIJNISTTOF-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