General Information of the Compound
| Compound ID |
CP0405822
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| Compound Name |
4-[4-(2-methoxyphenyl)piperazin-1-yl]-N-pyrazolo[1,5-a]pyridin-5-ylbutanamide
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| Structure |
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| Formula |
C22H27N5O2
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| Molecular Weight |
393.491
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| Canonical SMILES |
COc1ccccc1N1CCN(CCCC(=O)Nc2ccn3nccc3c2)CC1
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| InChI |
InChI=1S/C22H27N5O2/c1-29-21-6-3-2-5-20(21)26-15-13-25(14-16-26)11-4-7-22(28)24-18-9-12-27-19(17-18)8-10-23-27/h2-3,5-6,8-10,12,17H,4,7,11,13-16H2,1H3,(H,24,28)
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| InChIKey |
LKXCWTFZOCKBJZ-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: PT00825, 5-hydroxytryptamine receptor 2A
Protein ID: PT01195, D(1A) dopamine receptor
Protein ID: PT01005, D(2) dopamine receptor
Protein ID: PT00943, D(3) dopamine receptor
Protein ID: PT01161, D(4) dopamine receptor