General Information of the Compound
| Compound ID |
CP0497040
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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]benzimidazol-1-yl]acetamide
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| Structure |
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| Formula |
C25H19ClF2N6O2
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| Molecular Weight |
508.916
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| Canonical SMILES |
CC(=O)Nn1c(NCc2ccc(cc2F)-c2cc(Cl)cc(F)c2-c2noc(C)n2)nc2ccccc12
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| InChI |
InChI=1S/C25H19ClF2N6O2/c1-13(35)32-34-22-6-4-3-5-21(22)31-25(34)29-12-16-8-7-15(9-19(16)27)18-10-17(26)11-20(28)23(18)24-30-14(2)36-33-24/h3-11H,12H2,1-2H3,(H,29,31)(H,32,35)
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| InChIKey |
PPAIFISATSRVFV-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