General Information of the Compound
| Compound ID |
CP0356158
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| Compound Name |
2-[3-(4-fluorophenoxy)propyl]-1-(4-methoxyphenyl)guanidine
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| Structure |
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| Formula |
C17H20FN3O2
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| Molecular Weight |
317.364
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| Canonical SMILES |
COc1ccc(NC(=N)NCCCOc2ccc(F)cc2)cc1
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| InChI |
InChI=1S/C17H20FN3O2/c1-22-15-9-5-14(6-10-15)21-17(19)20-11-2-12-23-16-7-3-13(18)4-8-16/h3-10H,2,11-12H2,1H3,(H3,19,20,21)
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| InChIKey |
VAOKFJZCNXIHTK-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