General Information of the Compound
| Compound ID |
CP0883762
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| Compound Name |
(+/-)-trans-2-(4-Hydroxyphenyl)-1,2,3,4,4a,5,6,10b-octahydrobenzo[f]quinoline-8,9-diol Hydrobromide
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| Structure |
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| Formula |
C19H22BrNO3
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| Molecular Weight |
392.293
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| Canonical SMILES |
Br.Oc1ccc([C@H]2CN[C@@H]3CCc4cc(O)c(O)cc4[C@H]3C2)cc1
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| InChI |
InChI=1S/C19H21NO3.BrH/c21-14-4-1-11(2-5-14)13-7-16-15-9-19(23)18(22)8-12(15)3-6-17(16)20-10-13;/h1-2,4-5,8-9,13,16-17,20-23H,3,6-7,10H2;1H/t13-,16-,17-;/m1./s1
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| InChIKey |
HVXKRBGIMSFFEJ-WGUYJYMSSA-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: PT01195, D(1A) dopamine receptor
Protein ID: PT01005, D(2) dopamine receptor
Protein ID: PT00943, D(3) dopamine receptor