General Information of the Compound
| Compound ID |
CP0430707
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| Compound Name |
5,8,13,13a-Tetrahydro-6H-isoquino[3,2-a]isoquinolin-3-ol
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| Structure |
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| Formula |
C17H17NO
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| Molecular Weight |
251.329
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| Canonical SMILES |
Oc1ccc2C3Cc4ccccc4CN3CCc2c1
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| InChI |
InChI=1S/C17H17NO/c19-15-5-6-16-13(9-15)7-8-18-11-14-4-2-1-3-12(14)10-17(16)18/h1-6,9,17,19H,7-8,10-11H2
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| InChIKey |
QXUOSGAFYZBCAK-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: PT01195, D(1A) dopamine receptor
Protein ID: PT01169, D(1B) dopamine receptor
Protein ID: PT01005, D(2) dopamine receptor
Protein ID: PT00943, D(3) dopamine receptor
Protein ID: PT01161, D(4) dopamine receptor