General Information of the Compound
| Compound ID |
CP0468511
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| Compound Name |
3-((dimethylamino)methyl)-N,N-dimethyl-4-(4-(trifluoromethoxy)phenoxy)benzamide
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| Structure |
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| Formula |
C19H21F3N2O3
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| Molecular Weight |
382.382
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| Canonical SMILES |
CN(C)Cc1cc(ccc1Oc1ccc(OC(F)(F)F)cc1)C(=O)N(C)C
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| InChI |
InChI=1S/C19H21F3N2O3/c1-23(2)12-14-11-13(18(25)24(3)4)5-10-17(14)26-15-6-8-16(9-7-15)27-19(20,21)22/h5-11H,12H2,1-4H3
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| InChIKey |
WXULFWHQRUUESN-UHFFFAOYSA-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
Protein ID: PT00884, Sodium-dependent dopamine transporter
Protein ID: PT01026, Sodium-dependent noradrenaline transporter
Protein ID: PT00871, Sodium-dependent serotonin transporter