General Information of the Compound
| Compound ID |
CP0380813
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| Compound Name |
ethyl 5-[4-[4-(2,3-dichlorophenyl)piperazin-1-yl]butoxy]pyrazolo[1,5-a]pyridine-2-carboxylate
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| Structure |
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| Formula |
C24H28Cl2N4O3
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| Molecular Weight |
491.419
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| Canonical SMILES |
CCOC(=O)c1cc2cc(OCCCCN3CCN(CC3)c3cccc(Cl)c3Cl)ccn2n1
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| InChI |
InChI=1S/C24H28Cl2N4O3/c1-2-32-24(31)21-17-18-16-19(8-10-30(18)27-21)33-15-4-3-9-28-11-13-29(14-12-28)22-7-5-6-20(25)23(22)26/h5-8,10,16-17H,2-4,9,11-15H2,1H3
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| InChIKey |
HXHZPLKJASKRCI-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