General Information of the Compound
| Compound ID |
CP0459092
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| Compound Name |
N-(4-chloro-2,6-difluorophenyl)-2-[5-[(2-methoxyphenyl)methyl]-3-methyl-6-oxopyridazin-1-yl]acetamide
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| Structure |
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| Formula |
C21H18ClF2N3O3
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| Molecular Weight |
433.842
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| Canonical SMILES |
COc1ccccc1Cc1cc(C)nn(CC(=O)Nc2c(F)cc(Cl)cc2F)c1=O
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| InChI |
InChI=1S/C21H18ClF2N3O3/c1-12-7-14(8-13-5-3-4-6-18(13)30-2)21(29)27(26-12)11-19(28)25-20-16(23)9-15(22)10-17(20)24/h3-7,9-10H,8,11H2,1-2H3,(H,25,28)
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| InChIKey |
BEEJCABMLRUKCE-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