General Information of the Compound
| Compound ID |
CP0894247
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| Compound Name |
1,1'-(pentane-1,5-diyl)bis(8-isopropyl-2-methylisoquinolinium)iodide
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| Structure |
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| Formula |
C31H40I2N2
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| Molecular Weight |
694.483
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| Canonical SMILES |
CC(C)c1cccc2cc[n+](C)c(CCCCCc3c4c(C(C)C)cccc4cc[n+]3C)c12.[I-].[I-]
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| InChI |
InChI=1S/C31H40N2.2HI/c1-22(2)26-14-10-12-24-18-20-32(5)28(30(24)26)16-8-7-9-17-29-31-25(19-21-33(29)6)13-11-15-27(31)23(3)4;;/h10-15,18-23H,7-9,16-17H2,1-6H3;2*1H/q+2;;/p-2
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| InChIKey |
FSXJKPBKKXVEDR-UHFFFAOYSA-L
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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
Protein ID: PT05865, Small conductance calcium-activated potassium channel protein 2
Protein ID: PT04088, Small conductance calcium-activated potassium channel protein 3