General Information of the Compound
| Compound ID |
CP0560324
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| Compound Name |
US8754233, 5-(2-Chloro-pyridin-3-yl)-4-(5-fluoro-6-methoxy-benzothiazol-2-yl)-2H-pyrazol-3-ylamine
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| Structure |
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| Formula |
C16H11ClFN5OS
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| Molecular Weight |
375.816
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| Canonical SMILES |
COc1cc2sc(nc2cc1F)-c1c(N)[nH]nc1-c1cccnc1Cl
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| InChI |
InChI=1S/C16H11ClFN5OS/c1-24-10-6-11-9(5-8(10)18)21-16(25-11)12-13(22-23-15(12)19)7-3-2-4-20-14(7)17/h2-6H,1H3,(H3,19,22,23)
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| InChIKey |
LXMBHKHXRGNWDB-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