General Information of the Compound
| Compound ID |
CP0559235
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| Compound Name |
(2S)-4-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]-2-(phenoxymethyl)morpholine
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| Structure |
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| Formula |
C19H19F4NO2
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| Molecular Weight |
369.358
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| Canonical SMILES |
Fc1cc(CN2CCO[C@H](COc3ccccc3)C2)ccc1C(F)(F)F
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| InChI |
InChI=1S/C19H19F4NO2/c20-18-10-14(6-7-17(18)19(21,22)23)11-24-8-9-25-16(12-24)13-26-15-4-2-1-3-5-15/h1-7,10,16H,8-9,11-13H2/t16-/m0/s1
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| InChIKey |
FHUKVZCMEJSTKP-INIZCTEOSA-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