General Information of the Compound
| Compound ID |
CP0231468
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| Compound Name |
3-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-(1,3-thiazol-2-yl)pyridin-2-amine
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| Structure |
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| Formula |
C16H12Cl2FN3OS
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| Molecular Weight |
384.263
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| Canonical SMILES |
CC(Oc1cc(cnc1N)-c1nccs1)c1c(Cl)ccc(F)c1Cl
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| InChI |
InChI=1S/C16H12Cl2FN3OS/c1-8(13-10(17)2-3-11(19)14(13)18)23-12-6-9(7-22-15(12)20)16-21-4-5-24-16/h2-8H,1H3,(H2,20,22)
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| InChIKey |
GCKFRNJDXNHRHZ-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