General Information of the Compound
| Compound ID |
CP0489568
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| Compound Name |
N-[N'-[(3-chloro-5-pyridin-3-ylphenyl)methyl]carbamimidoyl]-3-(4-methoxyphenyl)-5-methyl-1,2-oxazole-4-carboxamide
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| Structure |
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| Formula |
C25H22ClN5O3
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| Molecular Weight |
475.936
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| Canonical SMILES |
COc1ccc(cc1)-c1noc(C)c1C(=O)NC(N)=NCc1cc(Cl)cc(c1)-c1cccnc1
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| InChI |
InChI=1S/C25H22ClN5O3/c1-15-22(23(31-34-15)17-5-7-21(33-2)8-6-17)24(32)30-25(27)29-13-16-10-19(12-20(26)11-16)18-4-3-9-28-14-18/h3-12,14H,13H2,1-2H3,(H3,27,29,30,32)
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| InChIKey |
JPMUQPOVJUOFEY-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