General Information of the Compound
| Compound ID |
CP0467269
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| Compound Name |
N-[N'-[(3-chloro-5-thiophen-3-ylphenyl)methyl]carbamimidoyl]-3-(4-methoxyphenyl)-5-methyl-1,2-oxazole-4-carboxamide
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| Structure |
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| Formula |
C24H21ClN4O3S
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| Molecular Weight |
480.977
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| Canonical SMILES |
COc1ccc(cc1)-c1noc(C)c1C(=O)NC(N)=NCc1cc(Cl)cc(c1)-c1ccsc1
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| InChI |
InChI=1S/C24H21ClN4O3S/c1-14-21(22(29-32-14)16-3-5-20(31-2)6-4-16)23(30)28-24(26)27-12-15-9-18(11-19(25)10-15)17-7-8-33-13-17/h3-11,13H,12H2,1-2H3,(H3,26,27,28,30)
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| InChIKey |
UTTBFSIUUZDEJB-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