General Information of the Compound
| Compound ID |
CP0422992
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| Compound Name |
N-(4-chlorophenyl)-2-[5-[(2-methoxyphenyl)methyl]-3-methyl-6-oxopyridazin-1-yl]pentanamide
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| Structure |
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| Formula |
C24H26ClN3O3
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| Molecular Weight |
439.943
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| Canonical SMILES |
CCCC(C(=O)Nc1ccc(Cl)cc1)n1nc(C)cc(Cc2ccccc2OC)c1=O
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| InChI |
InChI=1S/C24H26ClN3O3/c1-4-7-21(23(29)26-20-12-10-19(25)11-13-20)28-24(30)18(14-16(2)27-28)15-17-8-5-6-9-22(17)31-3/h5-6,8-14,21H,4,7,15H2,1-3H3,(H,26,29)
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| InChIKey |
ZNWCNDONFNUNHY-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