General Information of the Compound
| Compound ID |
CP0510747
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| Compound Name |
N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-4-(trifluoromethoxy)benzamide
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| Structure |
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| Formula |
C18H14F4N2O2
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| Molecular Weight |
366.314
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| Canonical SMILES |
Fc1ccc2[nH]cc(CCNC(=O)c3ccc(OC(F)(F)F)cc3)c2c1
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| InChI |
InChI=1S/C18H14F4N2O2/c19-13-3-6-16-15(9-13)12(10-24-16)7-8-23-17(25)11-1-4-14(5-2-11)26-18(20,21)22/h1-6,9-10,24H,7-8H2,(H,23,25)
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| InChIKey |
KKNXLXURTFSILT-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