General Information of the Compound
| Compound ID |
CP0449378
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| Compound Name |
2-[4-(3,4-dichlorophenyl)piperazin-1-ylmethyl]-6-(4-methylpiperazin-1-yl)imidazo[1,2-b]pyridazine
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| Structure |
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| Formula |
C22H27Cl2N7
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| Molecular Weight |
460.413
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| Canonical SMILES |
CN1CCN(CC1)c1ccc2nc(CN3CCN(CC3)c3ccc(Cl)c(Cl)c3)cn2n1
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| InChI |
InChI=1S/C22H27Cl2N7/c1-27-6-10-30(11-7-27)22-5-4-21-25-17(16-31(21)26-22)15-28-8-12-29(13-9-28)18-2-3-19(23)20(24)14-18/h2-5,14,16H,6-13,15H2,1H3
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| InChIKey |
VSESOHHTOBROFA-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
Protein ID: PT01005, D(2) dopamine receptor
Protein ID: PT00943, D(3) dopamine receptor
Protein ID: PT01161, D(4) dopamine receptor