General Information of the Compound
| Compound ID |
CP0509057
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| Compound Name |
(2S)-4-[(3-chloro-4-methoxyphenyl)methyl]-2-[(6-fluoropyridin-2-yl)oxymethyl]morpholine
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| Structure |
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| Formula |
C18H20ClFN2O3
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| Molecular Weight |
366.82
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| Canonical SMILES |
COc1ccc(CN2CCO[C@H](COc3cccc(F)n3)C2)cc1Cl
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| InChI |
InChI=1S/C18H20ClFN2O3/c1-23-16-6-5-13(9-15(16)19)10-22-7-8-24-14(11-22)12-25-18-4-2-3-17(20)21-18/h2-6,9,14H,7-8,10-12H2,1H3/t14-/m0/s1
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| InChIKey |
RJHQARBNQIFFJJ-AWEZNQCLSA-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