General Information of the Compound
| Compound ID |
CP0392511
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| Compound Name |
7-phenyl-1-[5-[5-(trifluoromethyl)pyridin-2-yl]-1,3-oxazol-2-yl]heptan-1-one
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| Structure |
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| Formula |
C22H21F3N2O2
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| Molecular Weight |
402.416
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| Canonical SMILES |
FC(F)(F)c1ccc(nc1)-c1cnc(o1)C(=O)CCCCCCc1ccccc1
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| InChI |
InChI=1S/C22H21F3N2O2/c23-22(24,25)17-12-13-18(26-14-17)20-15-27-21(29-20)19(28)11-7-2-1-4-8-16-9-5-3-6-10-16/h3,5-6,9-10,12-15H,1-2,4,7-8,11H2
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| InChIKey |
BAGGAODIFOJQHV-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