General Information of the Compound
| Compound ID |
CP0559234
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| Compound Name |
(2S)-4-[(4-methoxyphenyl)methyl]-2-(phenoxymethyl)morpholine
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| Structure |
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| Formula |
C19H23NO3
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| Molecular Weight |
313.397
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| Canonical SMILES |
COc1ccc(CN2CCO[C@H](COc3ccccc3)C2)cc1
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| InChI |
InChI=1S/C19H23NO3/c1-21-17-9-7-16(8-10-17)13-20-11-12-22-19(14-20)15-23-18-5-3-2-4-6-18/h2-10,19H,11-15H2,1H3/t19-/m0/s1
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| InChIKey |
RQXFLAKTVTURTA-IBGZPJMESA-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