General Information of the Compound
| Compound ID |
CP0403645
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| Compound Name |
US8754233, 4-(5-Fluoro-6-methoxy-benzothiazol-2-yl)-5-(4-methoxy-phenyl)-2H-pyrazol-3-ylamine
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| Structure |
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| Formula |
C18H15FN4O2S
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| Molecular Weight |
370.409
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| Canonical SMILES |
COc1ccc(cc1)-c1n[nH]c(N)c1-c1nc2cc(F)c(OC)cc2s1
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| InChI |
InChI=1S/C18H15FN4O2S/c1-24-10-5-3-9(4-6-10)16-15(17(20)23-22-16)18-21-12-7-11(19)13(25-2)8-14(12)26-18/h3-8H,1-2H3,(H3,20,22,23)
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| InChIKey |
HFLDOVRSMKAWPE-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