General Information of the Compound
| Compound ID |
CP0856327
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| Compound Name |
[2-[(2R)-3-(diethylamino)-2-hydroxypropoxy]phenyl]-phenylmethanone
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| Structure |
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| Formula |
C20H25NO3
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| Molecular Weight |
327.424
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| Canonical SMILES |
CCN(CC)C[C@@H](O)COc1ccccc1C(=O)c1ccccc1
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| InChI |
InChI=1S/C20H25NO3/c1-3-21(4-2)14-17(22)15-24-19-13-9-8-12-18(19)20(23)16-10-6-5-7-11-16/h5-13,17,22H,3-4,14-15H2,1-2H3/t17-/m1/s1
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| InChIKey |
GMNUWTLMPFWNMY-QGZVFWFLSA-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