General Information of the Compound
| Compound ID |
CP0107241
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| Compound Name |
2-(2-Dimethylaminomethyl-phenylsulfanyl)-5-methoxy-phenylamine
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| Structure |
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| Formula |
C16H20N2OS
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| Molecular Weight |
288.416
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| Canonical SMILES |
COc1ccc(Sc2ccccc2CN(C)C)c(N)c1
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| InChI |
InChI=1S/C16H20N2OS/c1-18(2)11-12-6-4-5-7-15(12)20-16-9-8-13(19-3)10-14(16)17/h4-10H,11,17H2,1-3H3
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| InChIKey |
HYOCZQPMJUZYKD-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