General Information of the Compound
| Compound ID |
CP0429881
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| Compound Name |
2,8,9,13b-Tetrahydro-6H-isoquino[2,1-b]pyrrolo[4,3,2-de]-isoquinoline
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| Structure |
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| Formula |
C18H16N2
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| Molecular Weight |
260.34
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| Canonical SMILES |
C1Cc2ccccc2C2N1Cc1cccc3[nH]cc2c13
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| InChI |
InChI=1S/C18H16N2/c1-2-6-14-12(4-1)8-9-20-11-13-5-3-7-16-17(13)15(10-19-16)18(14)20/h1-7,10,18-19H,8-9,11H2
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| InChIKey |
VAGUGVHWYBXLRK-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