General Information of the Compound
| Compound ID |
CP0540059
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| Compound Name |
8-methyl-6-phenyl-6,7,9,10-tetrahydro-4H-[1,4]oxazino[2,3-h][3]benzazepin-3-one
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| Structure |
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| Formula |
C19H20N2O2
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| Molecular Weight |
308.381
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| Canonical SMILES |
CN1CCc2cc3OCC(=O)Nc3cc2C(C1)c1ccccc1
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| InChI |
InChI=1S/C19H20N2O2/c1-21-8-7-14-9-18-17(20-19(22)12-23-18)10-15(14)16(11-21)13-5-3-2-4-6-13/h2-6,9-10,16H,7-8,11-12H2,1H3,(H,20,22)
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| InChIKey |
YSGKLWGOMLHFLD-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: PT01005, D(2) dopamine receptor