General Information of the Compound
| Compound ID |
CP0136843
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| Compound Name |
7-[4-[4-(2,3-Dichlorophenyl)piperazin-1-yl]butyloxy]quinoline
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| Structure |
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| Formula |
C23H25Cl2N3O
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| Molecular Weight |
430.379
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| Canonical SMILES |
Clc1cccc(N2CCN(CCCCOc3ccc4cccnc4c3)CC2)c1Cl
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| InChI |
InChI=1S/C23H25Cl2N3O/c24-20-6-3-7-22(23(20)25)28-14-12-27(13-15-28)11-1-2-16-29-19-9-8-18-5-4-10-26-21(18)17-19/h3-10,17H,1-2,11-16H2
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| InChIKey |
FUOMYSOASQSWCG-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