General Information of the Compound
| Compound ID |
CP0122729
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| Compound Name |
1-(2-chlorophenyl)-5-(4-chlorophenyl)-3-(1-isopropyl-1H-imidazol-4-yl)-4-methyl-1H-pyrazole
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| Structure |
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| Formula |
C22H20Cl2N4
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| Molecular Weight |
411.336
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| Canonical SMILES |
CC(C)n1cnc(c1)-c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccccc1Cl
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| InChI |
InChI=1S/C22H20Cl2N4/c1-14(2)27-12-19(25-13-27)21-15(3)22(16-8-10-17(23)11-9-16)28(26-21)20-7-5-4-6-18(20)24/h4-14H,1-3H3
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| InChIKey |
NKBQZUQMWOWSFW-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