General Information of the Compound
| Compound ID |
CP0414637
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| Compound Name |
4-[4-[4-(2,3-dichlorophenyl)piperazin-1-yl]butoxy]pyrazolo[1,5-a]pyridine
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| Structure |
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| Formula |
C21H24Cl2N4O
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| Molecular Weight |
419.356
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| Canonical SMILES |
Clc1cccc(N2CCN(CCCCOc3cccn4nccc34)CC2)c1Cl
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| InChI |
InChI=1S/C21H24Cl2N4O/c22-17-5-3-6-19(21(17)23)26-14-12-25(13-15-26)10-1-2-16-28-20-7-4-11-27-18(20)8-9-24-27/h3-9,11H,1-2,10,12-16H2
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| InChIKey |
WUVBFCGMNNHUHJ-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