General Information of the Compound
| Compound ID |
CP0866637
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| Compound Name |
2-(4-(3-(piperidin-1-yl)propoxy)phenyl)-3-oxa-1-azaspiro[4.5]dec-1-ene
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| Structure |
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| Formula |
C22H32N2O2
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| Molecular Weight |
356.51
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| Canonical SMILES |
c1cc(C2=NC3(CCCCC3)CO2)ccc1OCCCN1CCCCC1
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| InChI |
InChI=1S/C22H32N2O2/c1-3-12-22(13-4-1)18-26-21(23-22)19-8-10-20(11-9-19)25-17-7-16-24-14-5-2-6-15-24/h8-11H,1-7,12-18H2
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| InChIKey |
KFBRHFYLJBVFGK-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