General Information of the Compound
| Compound ID |
CP0835385
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| Compound Name |
6-(4-(6-chloro-1,2,3,4-tetrahydroacridin-9-ylamino)butylamino)-5,6,7,8-tetrahydroquinolin-2(1H)-one
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| Structure |
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| Formula |
C26H31ClN4O
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| Molecular Weight |
451.014
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| Canonical SMILES |
O=c1ccc2c([nH]1)CCC(NCCCCNc1c3c(nc4cc(Cl)ccc14)CCCC3)C2
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| InChI |
InChI=1S/C26H31ClN4O/c27-18-8-10-21-24(16-18)30-23-6-2-1-5-20(23)26(21)29-14-4-3-13-28-19-9-11-22-17(15-19)7-12-25(32)31-22/h7-8,10,12,16,19,28H,1-6,9,11,13-15H2,(H,29,30)(H,31,32)
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| InChIKey |
NJEJUEDROIGPNO-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