General Information of the Compound
| Compound ID |
CP0525507
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| Compound Name |
1-(2-(2-hydroxy-3-(piperidin-1-yl)propoxy)phenyl)propan-1-one
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| Structure |
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| Formula |
C17H25NO3
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| Molecular Weight |
291.391
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| Canonical SMILES |
CCC(=O)c1ccccc1OCC(O)CN1CCCCC1
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| InChI |
InChI=1S/C17H25NO3/c1-2-16(20)15-8-4-5-9-17(15)21-13-14(19)12-18-10-6-3-7-11-18/h4-5,8-9,14,19H,2-3,6-7,10-13H2,1H3
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| InChIKey |
PWRSYYZDBDKVDF-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