General Information of the Compound
| Compound ID |
CP0559092
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| Compound Name |
5-[2-(5,6,7-trifluoro-1H-indol-3-yl)quinolin-5-yl]-1,3-thiazole
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| Structure |
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| Formula |
C20H10F3N3S
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| Molecular Weight |
381.382
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| Canonical SMILES |
Fc1cc2c(c[nH]c2c(F)c1F)-c1ccc2c(cccc2n1)-c1cncs1
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| InChI |
InChI=1S/C20H10F3N3S/c21-14-6-12-13(7-25-20(12)19(23)18(14)22)16-5-4-10-11(17-8-24-9-27-17)2-1-3-15(10)26-16/h1-9,25H
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| InChIKey |
PEVMORAZGXOGGJ-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