General Information of the Compound
| Compound ID |
CP0385239
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| Compound Name |
1-[7-(2-methoxyphenyl)-1,3-benzodioxol-5-yl]-N-methylmethanamine
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| Structure |
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| Formula |
C16H17NO3
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| Molecular Weight |
271.316
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| Canonical SMILES |
CNCc1cc2OCOc2c(c1)-c1ccccc1OC
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| InChI |
InChI=1S/C16H17NO3/c1-17-9-11-7-13(16-15(8-11)19-10-20-16)12-5-3-4-6-14(12)18-2/h3-8,17H,9-10H2,1-2H3
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| InChIKey |
SDJRJZVZVFOJIP-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