General Information of the Compound
| Compound ID |
CP0548677
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| Compound Name |
N-[4-(4-acetylpiperazin-1-yl)phenyl]-5-(2-fluoroanilino)-1,3,4-oxadiazole-2-carboxamide
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| Structure |
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| Formula |
C21H21FN6O3
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| Molecular Weight |
424.436
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| Canonical SMILES |
CC(=O)N1CCN(CC1)c1ccc(NC(=O)c2nnc(Nc3ccccc3F)o2)cc1
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| InChI |
InChI=1S/C21H21FN6O3/c1-14(29)27-10-12-28(13-11-27)16-8-6-15(7-9-16)23-19(30)20-25-26-21(31-20)24-18-5-3-2-4-17(18)22/h2-9H,10-13H2,1H3,(H,23,30)(H,24,26)
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| InChIKey |
KTHOPPXEAJKDJZ-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