General Information of the Compound
| Compound ID |
CP0566600
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| Compound Name |
N'-(3-cyanophenyl)-N-hydroxy-4-[2-[[methoxy(methyl)phosphoryl]amino]ethylamino]-1,2,5-oxadiazole-3-carboximidamide
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| Structure |
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| Formula |
C14H18N7O4P
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| Molecular Weight |
379.317
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| Canonical SMILES |
COP(C)(=O)NCCNc1nonc1\C(Nc1cccc(c1)C#N)=N\O
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| InChI |
InChI=1S/C14H18N7O4P/c1-24-26(2,23)17-7-6-16-13-12(20-25-21-13)14(19-22)18-11-5-3-4-10(8-11)9-15/h3-5,8,22H,6-7H2,1-2H3,(H,16,21)(H,17,23)(H,18,19)
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| InChIKey |
AHYGWSRZCKMAGU-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