General Information of the Compound
| Compound ID |
CP0386478
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| Compound Name |
7-(propyl(2-(4-(pyrimidin-2-yl)piperazin-1-yl)ethyl)amino)-5,6,7,8-tetrahydronaphthalen-2-ol
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| Structure |
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| Formula |
C23H33N5O
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| Molecular Weight |
395.551
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| Canonical SMILES |
CCCN(CCN1CCN(CC1)c1ncccn1)C1CCc2ccc(O)cc2C1
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| InChI |
InChI=1S/C23H33N5O/c1-2-10-27(21-6-4-19-5-7-22(29)18-20(19)17-21)14-11-26-12-15-28(16-13-26)23-24-8-3-9-25-23/h3,5,7-9,18,21,29H,2,4,6,10-17H2,1H3
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| InChIKey |
QPFPLXIMWCZMQV-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: PT00957, D(2) dopamine receptor
Protein ID: PT01366, D(3) dopamine receptor