General Information of the Compound
| Compound ID |
CP0476164
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| Compound Name |
1,1'-(3,3'-(9-oxo-8a,9-dihydroacridine-3,6-diyl)bis(azanediyl)bis(3-oxopropane-3,1-diyl))dipiperidine 1-oxide
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| Structure |
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| Formula |
C29H37N5O5
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| Molecular Weight |
535.645
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| Canonical SMILES |
Oc1c2ccc(NC(=O)CC[N+]3([O-])CCCCC3)cc2nc2cc(NC(=O)CC[N+]3([O-])CCCCC3)ccc12
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| InChI |
InChI=1S/C29H37N5O5/c35-27(11-17-33(38)13-3-1-4-14-33)30-21-7-9-23-25(19-21)32-26-20-22(8-10-24(26)29(23)37)31-28(36)12-18-34(39)15-5-2-6-16-34/h7-10,19-20H,1-6,11-18H2,(H,30,35)(H,31,36)(H,32,37)
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| InChIKey |
HGQMGHIMYLBSFS-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