General Information of the Compound
| Compound ID |
CP0465064
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| Compound Name |
N-(4-chlorophenyl)-6-[[4-(2,4-dimethyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]amino]-N-methylpyridine-3-carboxamide
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| Structure |
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| Formula |
C21H18ClN5OS2
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| Molecular Weight |
455.996
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| Canonical SMILES |
CN(C(=O)c1ccc(Nc2nc(cs2)-c2sc(C)nc2C)nc1)c1ccc(Cl)cc1
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| InChI |
InChI=1S/C21H18ClN5OS2/c1-12-19(30-13(2)24-12)17-11-29-21(25-17)26-18-9-4-14(10-23-18)20(28)27(3)16-7-5-15(22)6-8-16/h4-11H,1-3H3,(H,23,25,26)
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| InChIKey |
JLQOXYDMDNLRLN-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