General Information of the Compound
| Compound ID |
CP0489570
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| Compound Name |
N-(N'-benzylcarbamimidoyl)-3-(4-methoxyphenyl)-5-methyl-1,2-oxazole-4-carboxamide
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| Structure |
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| Formula |
C20H20N4O3
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| Molecular Weight |
364.405
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| Canonical SMILES |
COc1ccc(cc1)-c1noc(C)c1C(=O)NC(N)=NCc1ccccc1
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| InChI |
InChI=1S/C20H20N4O3/c1-13-17(18(24-27-13)15-8-10-16(26-2)11-9-15)19(25)23-20(21)22-12-14-6-4-3-5-7-14/h3-11H,12H2,1-2H3,(H3,21,22,23,25)
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| InChIKey |
PTAYSGKMHQTIBK-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