General Information of the Compound
| Compound ID |
CP0524549
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| Compound Name |
1-[6-methoxy-9-(4-methoxyphenyl)sulfonyl-1,2,3,4-tetrahydrocarbazol-4-yl]-N,N-dimethylmethanamine
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| Structure |
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| Formula |
C23H28N2O4S
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| Molecular Weight |
428.554
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| Canonical SMILES |
COc1ccc(cc1)S(=O)(=O)n1c2CCCC(CN(C)C)c2c2cc(OC)ccc12
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| InChI |
InChI=1S/C23H28N2O4S/c1-24(2)15-16-6-5-7-22-23(16)20-14-18(29-4)10-13-21(20)25(22)30(26,27)19-11-8-17(28-3)9-12-19/h8-14,16H,5-7,15H2,1-4H3
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| InChIKey |
WIZPZSPDDVRVEJ-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