General Information of the Compound
| Compound ID |
CP0948380
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| Compound Name |
1-[3-[(2R)-2-hydroxy-3-piperidin-1-ylpropoxy]phenyl]ethanone
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| Structure |
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| Formula |
C16H23NO3
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| Molecular Weight |
277.364
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| Canonical SMILES |
CC(=O)c1cccc(OC[C@H](O)CN2CCCCC2)c1
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| InChI |
InChI=1S/C16H23NO3/c1-13(18)14-6-5-7-16(10-14)20-12-15(19)11-17-8-3-2-4-9-17/h5-7,10,15,19H,2-4,8-9,11-12H2,1H3/t15-/m1/s1
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| InChIKey |
FPWIQSIIEYYWPP-OAHLLOKOSA-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