General Information of the Compound
| Compound ID |
CP0474733
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| Compound Name |
US8754233, 4-(5-Fluoro-6-methyl-benzothiazol-2-yl)-5-methyl-2H-pyrazol-3-ylamine
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| Structure |
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| Formula |
C12H11FN4S
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| Molecular Weight |
262.313
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| Canonical SMILES |
Cc1[nH]nc(N)c1-c1nc2cc(F)c(C)cc2s1
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| InChI |
InChI=1S/C12H11FN4S/c1-5-3-9-8(4-7(5)13)15-12(18-9)10-6(2)16-17-11(10)14/h3-4H,1-2H3,(H3,14,16,17)
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| InChIKey |
SVURQPBGWDIMSF-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