General Information of the Compound
| Compound ID |
CP0405787
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| Compound Name |
3-[[4-(4-chlorophenyl)piperazin-1-yl]methyl]-7-iodopyrazolo[1,5-a]pyridine
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| Structure |
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| Formula |
C18H18ClIN4
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| Molecular Weight |
452.727
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| Canonical SMILES |
Clc1ccc(cc1)N1CCN(Cc2cnn3c(I)cccc23)CC1
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| InChI |
InChI=1S/C18H18ClIN4/c19-15-4-6-16(7-5-15)23-10-8-22(9-11-23)13-14-12-21-24-17(14)2-1-3-18(24)20/h1-7,12H,8-11,13H2
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| InChIKey |
DQWYVTVADJXAAR-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: PT00943, D(3) dopamine receptor
Protein ID: PT01161, D(4) dopamine receptor