General Information of the Compound
| Compound ID |
CP0476542
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| Compound Name |
(6S)-6-[9-phenylnonyl(propyl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol
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| Structure |
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| Formula |
C28H41NO
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| Molecular Weight |
407.642
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| Canonical SMILES |
CCCN(CCCCCCCCCc1ccccc1)[C@H]1CCc2c(O)cccc2C1
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| InChI |
InChI=1S/C28H41NO/c1-2-21-29(26-19-20-27-25(23-26)17-13-18-28(27)30)22-12-7-5-3-4-6-9-14-24-15-10-8-11-16-24/h8,10-11,13,15-18,26,30H,2-7,9,12,14,19-23H2,1H3/t26-/m0/s1
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| InChIKey |
HVFVTDPHUINJDO-SANMLTNESA-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