General Information of the Compound
| Compound ID |
CP0885362
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| Compound Name |
2,2'-[4,5-Acridindiylbis(methyleneimino)]bis[N-methyl-N-(2-oxoethyl)pyrrolidinium]diiodide
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| Structure |
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| Formula |
C29H39I2N5O2
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| Molecular Weight |
743.472
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| Canonical SMILES |
C[N+]1(CC(=O)NCc2cccc3cc4cccc(CNC(=O)C[N+]5(C)CCCC5)c4nc23)CCCC1.[I-].[I-]
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| InChI |
InChI=1S/C29H37N5O2.2HI/c1-33(13-3-4-14-33)20-26(35)30-18-24-11-7-9-22-17-23-10-8-12-25(29(23)32-28(22)24)19-31-27(36)21-34(2)15-5-6-16-34;;/h7-12,17H,3-6,13-16,18-21H2,1-2H3;2*1H
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| InChIKey |
WAZFAULKZVVLDJ-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