General Information of the Compound
| Compound ID |
CP0393753
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| Compound Name |
ethyl 5-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butoxy]pyrazolo[1,5-a]pyridine-2-carboxylate
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| Structure |
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| Formula |
C25H32N4O4
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| Molecular Weight |
452.555
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| Canonical SMILES |
CCOC(=O)c1cc2cc(OCCCCN3CCN(CC3)c3ccccc3OC)ccn2n1
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| InChI |
InChI=1S/C25H32N4O4/c1-3-32-25(30)22-19-20-18-21(10-12-29(20)26-22)33-17-7-6-11-27-13-15-28(16-14-27)23-8-4-5-9-24(23)31-2/h4-5,8-10,12,18-19H,3,6-7,11,13-17H2,1-2H3
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| InChIKey |
HSTZLQFEUGWBDW-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