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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors
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3
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Hydrogen bond donors
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2
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Rotatable bonds
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7
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Topological polar surface area
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65.98
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Molecular weight
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374.2
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XLogP
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5.82
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No. Lipinski's rules broken
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1
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SMILES / InChI / InChIKey
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Canonical SMILES
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OC(=O)c1ccccc1c1ccc(cc1)CCc1ncc([nH]1)CC1CCCC1
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Isomeric SMILES
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OC(=O)c1ccccc1c1ccc(cc1)CCc1ncc([nH]1)CC1CCCC1
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InChI
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InChI=1S/C24H26N2O2/c27-24(28)22-8-4-3-7-21(22)19-12-9-17(10-13-19)11-14-23-25-16-20(26-23)15-18-5-1-2-6-18/h3-4,7-10,12-13,16,18H,1-2,5-6,11,14-15H2,(H,25,26)(H,27,28)
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InChI Key
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OENIXTHWZWFYIV-UHFFFAOYSA-N
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