General Information of the Compound
| Compound ID |
CP0411949
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| Compound Name |
7-(propyl(2-(4-(pyridin-4-yl)piperazin-1-yl)ethyl)amino)-5,6,7,8-tetrahydronaphthalen-2-ol
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| Structure |
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| Formula |
C24H34N4O
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| Molecular Weight |
394.563
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| Canonical SMILES |
CCCN(CCN1CCN(CC1)c1ccncc1)C1CCc2ccc(O)cc2C1
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| InChI |
InChI=1S/C24H34N4O/c1-2-11-27(23-5-3-20-4-6-24(29)19-21(20)18-23)15-12-26-13-16-28(17-14-26)22-7-9-25-10-8-22/h4,6-10,19,23,29H,2-3,5,11-18H2,1H3
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| InChIKey |
JBAHBJRMOBCAFP-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