General Information of the Compound
| Compound ID |
CP0001143
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| Compound Name |
6,7-dimethoxy-2-methyl-2-propyl-3,4-dihydro-1H-isoquinolin-2-ium;iodide
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| Structure |
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| Formula |
C15H24INO2
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| Molecular Weight |
377.266
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| Canonical SMILES |
[I-].CCC[N+]1(C)CCc2cc(OC)c(OC)cc2C1
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| InChI |
InChI=1S/C15H24NO2.HI/c1-5-7-16(2)8-6-12-9-14(17-3)15(18-4)10-13(12)11-16;/h9-10H,5-8,11H2,1-4H3;1H/q+1;/p-1
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| InChIKey |
BWZCFPOGHNHOCC-UHFFFAOYSA-M
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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