General Information of the Compound
| Compound ID |
CP0858690
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| Compound Name |
N-(diaminomethylene)-2-(2-methoxyphenyl)-5-methyl-1H-imidazole-4-carboxamide dimethanesulfonate
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| Structure |
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| Formula |
C15H23N5O8S2
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| Molecular Weight |
465.51
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| Canonical SMILES |
COc1ccccc1-c1nc(C(=O)N=C(N)N)c(C)[nH]1.CS(=O)(=O)O.CS(=O)(=O)O
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| InChI |
InChI=1S/C13H15N5O2.2CH4O3S/c1-7-10(12(19)18-13(14)15)17-11(16-7)8-5-3-4-6-9(8)20-2;2*1-5(2,3)4/h3-6H,1-2H3,(H,16,17)(H4,14,15,18,19);2*1H3,(H,2,3,4)
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| InChIKey |
CMQVHVYQTIHSRK-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