General Information of the Compound
| Compound ID |
CP0566598
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| Compound Name |
N'-(3-bromophenyl)-4-[2-[[ethoxy(ethyl)phosphoryl]amino]ethylamino]-N-hydroxy-1,2,5-oxadiazole-3-carboximidamide
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| Structure |
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| Formula |
C15H22BrN6O4P
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| Molecular Weight |
461.257
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| Canonical SMILES |
CCOP(=O)(CC)NCCNc1nonc1\C(Nc1cccc(Br)c1)=N\O
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| InChI |
InChI=1S/C15H22BrN6O4P/c1-3-25-27(24,4-2)18-9-8-17-14-13(21-26-22-14)15(20-23)19-12-7-5-6-11(16)10-12/h5-7,10,23H,3-4,8-9H2,1-2H3,(H,17,22)(H,18,24)(H,19,20)
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| InChIKey |
XRFHAZHGTKNHJB-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