General Information of the Compound
| Compound ID |
CP0143601
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| Compound Name |
ethyl 4-(9-chloro-5,6,7,8-tetrahydroacridine-3-carbonyl)piperazine-1-carboxylate
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| Structure |
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| Formula |
C21H24ClN3O3
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| Molecular Weight |
401.894
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| Canonical SMILES |
CCOC(=O)N1CCN(CC1)C(=O)c1ccc2c(Cl)c3CCCCc3nc2c1
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| InChI |
InChI=1S/C21H24ClN3O3/c1-2-28-21(27)25-11-9-24(10-12-25)20(26)14-7-8-16-18(13-14)23-17-6-4-3-5-15(17)19(16)22/h7-8,13H,2-6,9-12H2,1H3
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| InChIKey |
OPYQIDIGPBBBMA-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