General Information of the Compound
| Compound ID |
CP0393921
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| Compound Name |
8-[4-(4-pyrazolo[1,5-a]pyridin-5-yloxybutyl)piperazin-1-yl]-2,3-dihydro-1,4-benzodioxin-5-ol
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| Structure |
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| Formula |
C23H28N4O4
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| Molecular Weight |
424.501
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| Canonical SMILES |
Oc1ccc(N2CCN(CCCCOc3ccn4nccc4c3)CC2)c2OCCOc12
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| InChI |
InChI=1S/C23H28N4O4/c28-21-4-3-20(22-23(21)31-16-15-30-22)26-12-10-25(11-13-26)8-1-2-14-29-19-6-9-27-18(17-19)5-7-24-27/h3-7,9,17,28H,1-2,8,10-16H2
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| InChIKey |
ASSMUHYHXZFLKM-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: PT01169, D(1B) dopamine receptor
Protein ID: PT01005, D(2) dopamine receptor
Protein ID: PT00943, D(3) dopamine receptor
Protein ID: PT01161, D(4) dopamine receptor