General Information of the Compound
| Compound ID |
CP0564018
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| Compound Name |
1-(5-naphthalen-2-yloxypentyl)azepane
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| Structure |
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| Formula |
C21H29NO
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| Molecular Weight |
311.469
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| Canonical SMILES |
C(CCOc1ccc2ccccc2c1)CCN1CCCCCC1
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| InChI |
InChI=1S/C21H29NO/c1-2-7-15-22(14-6-1)16-8-3-9-17-23-21-13-12-19-10-4-5-11-20(19)18-21/h4-5,10-13,18H,1-3,6-9,14-17H2
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| InChIKey |
ABOKXOUWIZXILE-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