General Information of the Compound
| Compound ID |
CP0236246
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| Compound Name |
5-bromanyl-1-[(3,4-dichlorophenyl)methyl]-2-methyl-4-nitro-imidazole
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| Structure |
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| Formula |
C11H8BrCl2N3O2
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| Molecular Weight |
365.014
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| Canonical SMILES |
Cc1nc(c(Br)n1Cc1ccc(Cl)c(Cl)c1)[N+]([O-])=O
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| InChI |
InChI=1S/C11H8BrCl2N3O2/c1-6-15-11(17(18)19)10(12)16(6)5-7-2-3-8(13)9(14)4-7/h2-4H,5H2,1H3
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| InChIKey |
GUNDYOSMXWMGCV-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
Protein ID: PT06109, Geminin
Protein ID: PT02997, Isocitrate dehydrogenase [NADP] cytoplasmic
Protein ID: PT01214, Tyrosine-protein kinase JAK2