General Information of the Compound
| Compound ID |
CP0882654
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| Compound Name |
3-((2-chloro-4-(trifluoromethyl)phenoxy)methyl)-N-(3-methoxypropyl)benzamide
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| Structure |
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| Formula |
C19H19ClF3NO3
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| Molecular Weight |
401.812
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| Canonical SMILES |
COCCCNC(=O)c1cccc(COc2ccc(C(F)(F)F)cc2Cl)c1
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| InChI |
InChI=1S/C19H19ClF3NO3/c1-26-9-3-8-24-18(25)14-5-2-4-13(10-14)12-27-17-7-6-15(11-16(17)20)19(21,22)23/h2,4-7,10-11H,3,8-9,12H2,1H3,(H,24,25)
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| InChIKey |
MCSDDJPYBXCCHY-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