General Information of the Compound
| Compound ID |
CP0902434
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| Compound Name |
2,2'-[4,5-Acridindiylbis(methyleneimino)]bis[N-methyl-N-(3-oxopropyl)pyrrolidinium]diiodide
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| Structure |
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| Formula |
C31H43I2N5O2
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| Molecular Weight |
771.526
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| Canonical SMILES |
C[N+]1(CCC(=O)NCc2cccc3cc4cccc(CNC(=O)CC[N+]5(C)CCCC5)c4nc23)CCCC1.[I-].[I-]
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| InChI |
InChI=1S/C31H41N5O2.2HI/c1-35(15-3-4-16-35)19-13-28(37)32-22-26-11-7-9-24-21-25-10-8-12-27(31(25)34-30(24)26)23-33-29(38)14-20-36(2)17-5-6-18-36;;/h7-12,21H,3-6,13-20,22-23H2,1-2H3;2*1H
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| InChIKey |
FSLWOSNIEAEQER-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