General Information of the Compound
| Compound ID |
CP0425377
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| Compound Name |
6-chloro-2-[4-(4-fluorophenyl)piperazin-1-ylmethyl]imidazo[1,2-b]pyridazine
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| Structure |
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| Formula |
C17H17ClFN5
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| Molecular Weight |
345.809
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| Canonical SMILES |
Fc1ccc(cc1)N1CCN(Cc2cn3nc(Cl)ccc3n2)CC1
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| InChI |
InChI=1S/C17H17ClFN5/c18-16-5-6-17-20-14(12-24(17)21-16)11-22-7-9-23(10-8-22)15-3-1-13(19)2-4-15/h1-6,12H,7-11H2
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| InChIKey |
KLWCGZRXATXKMS-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