General Information of the Compound
| Compound ID |
CP0516155
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| Compound Name |
9-(benzenesulfonyl)-N,N-dimethyl-6-methylsulfanyl-1,2,3,4-tetrahydrocarbazol-3-amine
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| Structure |
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| Formula |
C21H24N2O2S2
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| Molecular Weight |
400.569
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| Canonical SMILES |
CSc1ccc2n(c3CCC(Cc3c2c1)N(C)C)S(=O)(=O)c1ccccc1
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| InChI |
InChI=1S/C21H24N2O2S2/c1-22(2)15-9-11-20-18(13-15)19-14-16(26-3)10-12-21(19)23(20)27(24,25)17-7-5-4-6-8-17/h4-8,10,12,14-15H,9,11,13H2,1-3H3
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| InChIKey |
VFIXEEIIZUMLIG-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