General Information of the Compound
| Compound ID |
CP0414666
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| Compound Name |
8-[[4-(3-piperidin-1-ylpropoxy)phenyl]methyl]-1,4-dioxa-8-azaspiro[4.5]decane
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| Structure |
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| Formula |
C22H34N2O3
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| Molecular Weight |
374.525
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| Canonical SMILES |
C(COc1ccc(CN2CCC3(CC2)OCCO3)cc1)CN1CCCCC1
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| InChI |
InChI=1S/C22H34N2O3/c1-2-11-23(12-3-1)13-4-16-25-21-7-5-20(6-8-21)19-24-14-9-22(10-15-24)26-17-18-27-22/h5-8H,1-4,9-19H2
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| InChIKey |
ZGAZKQWQIOPMTC-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