General Information of the Compound
| Compound ID |
CP0508655
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| Compound Name |
benzo[b][1]benzazepin-11-yl-(4-hydroxypiperidin-1-yl)methanone
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| Structure |
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| Formula |
C20H20N2O2
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| Molecular Weight |
320.392
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| Canonical SMILES |
OC1CCN(CC1)C(=O)N1c2ccccc2C=Cc2ccccc12
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| InChI |
InChI=1S/C20H20N2O2/c23-17-11-13-21(14-12-17)20(24)22-18-7-3-1-5-15(18)9-10-16-6-2-4-8-19(16)22/h1-10,17,23H,11-14H2
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| InChIKey |
NHQRIFAVIPFQMU-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