General Information of the Compound
| Compound ID |
CP0489567
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| Compound Name |
N-[N'-[(3,5-dichloro-4-propoxyphenyl)methyl]carbamimidoyl]-3-(4-methoxyphenyl)-5-methyl-1,2-oxazole-4-carboxamide
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| Structure |
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| Formula |
C23H24Cl2N4O4
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| Molecular Weight |
491.375
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| Canonical SMILES |
CCCOc1c(Cl)cc(CN=C(N)NC(=O)c2c(C)onc2-c2ccc(OC)cc2)cc1Cl
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| InChI |
InChI=1S/C23H24Cl2N4O4/c1-4-9-32-21-17(24)10-14(11-18(21)25)12-27-23(26)28-22(30)19-13(2)33-29-20(19)15-5-7-16(31-3)8-6-15/h5-8,10-11H,4,9,12H2,1-3H3,(H3,26,27,28,30)
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| InChIKey |
VJDZPEGKZDVQDE-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