General Information of the Compound
| Compound ID |
CP0572915
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| Compound Name |
9-(4-methylpiperazin-1-yl)-7-nitro-1,2,3,4-tetrahydroacridine
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| Structure |
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| Formula |
C18H22N4O2
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| Molecular Weight |
326.4
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| Canonical SMILES |
CN1CCN(CC1)c1c2CCCCc2nc2ccc(cc12)[N+]([O-])=O
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| InChI |
InChI=1S/C18H22N4O2/c1-20-8-10-21(11-9-20)18-14-4-2-3-5-16(14)19-17-7-6-13(22(23)24)12-15(17)18/h6-7,12H,2-5,8-11H2,1H3
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| InChIKey |
AAIVPEBVZWQHCI-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