General Information of the Compound
| Compound ID |
CP0439252
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| Compound Name |
7-((2-(4-(Naphthalen-2-yl)piperazin-1-yl)ethyl)(propyl)amino)-5,6,7,8-tetrahydronaphthalen-2-ol
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| Structure |
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| Formula |
C29H37N3O
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| Molecular Weight |
443.635
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| Canonical SMILES |
CCCN(CCN1CCN(CC1)c1ccc2ccccc2c1)C1CCc2ccc(O)cc2C1
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| InChI |
InChI=1S/C29H37N3O/c1-2-13-31(28-11-8-24-9-12-29(33)22-26(24)21-28)17-14-30-15-18-32(19-16-30)27-10-7-23-5-3-4-6-25(23)20-27/h3-7,9-10,12,20,22,28,33H,2,8,11,13-19,21H2,1H3
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| InChIKey |
UUXJEWIMBQSYJG-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: PT01005, D(2) dopamine receptor
Protein ID: PT00943, D(3) dopamine receptor