General Information of the Compound
| Compound ID |
CP0510487
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| Compound Name |
N-[2-[[4-[5-chloro-3-fluoro-2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-2-fluorophenyl]methylamino]-4,5-dimethylimidazol-1-yl]-3-methoxy-1,2-oxazole-5-carboxamide
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| Structure |
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| Formula |
C26H22ClF2N7O4
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| Molecular Weight |
569.956
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| Canonical SMILES |
COc1cc(on1)C(=O)Nn1c(C)c(C)nc1NCc1ccc(cc1F)-c1cc(Cl)cc(F)c1-c1noc(C)n1
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| InChI |
InChI=1S/C26H22ClF2N7O4/c1-12-13(2)36(33-25(37)21-10-22(38-4)34-40-21)26(31-12)30-11-16-6-5-15(7-19(16)28)18-8-17(27)9-20(29)23(18)24-32-14(3)39-35-24/h5-10H,11H2,1-4H3,(H,30,31)(H,33,37)
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| InChIKey |
IOMRQKCYHOEINE-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