General Information of the Compound
| Compound ID |
CP0271644
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| Compound Name |
2-amino-5-[4-fluoro-3-(2-fluoropyridin-3-yl)phenyl]-3-methyl-5-(1-propan-2-ylpyrazol-4-yl)imidazol-4-one
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| Structure |
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| Formula |
C21H20F2N6O
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| Molecular Weight |
410.428
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| Canonical SMILES |
CC(C)n1cc(cn1)C1(N=C(N)N(C)C1=O)c1ccc(F)c(c1)-c1cccnc1F
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| InChI |
InChI=1S/C21H20F2N6O/c1-12(2)29-11-14(10-26-29)21(19(30)28(3)20(24)27-21)13-6-7-17(22)16(9-13)15-5-4-8-25-18(15)23/h4-12H,1-3H3,(H2,24,27)
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| InChIKey |
HNEPKJNWZLGKMM-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