General Information of the Compound
| Compound ID |
CP0123597
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| Compound Name |
N-[4-(6-ethyl-7-methoxyquinolin-4-yl)oxy-3-fluorophenyl]-1,5-dimethyl-3-oxo-2-phenylpyrazole-4-carboxamide
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| Structure |
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| Formula |
C30H27FN4O4
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| Molecular Weight |
526.568
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| Canonical SMILES |
CCc1cc2c(Oc3ccc(NC(=O)c4c(C)n(C)n(-c5ccccc5)c4=O)cc3F)ccnc2cc1OC
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| InChI |
InChI=1S/C30H27FN4O4/c1-5-19-15-22-24(17-27(19)38-4)32-14-13-25(22)39-26-12-11-20(16-23(26)31)33-29(36)28-18(2)34(3)35(30(28)37)21-9-7-6-8-10-21/h6-17H,5H2,1-4H3,(H,33,36)
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| InChIKey |
DPDFZTKJHYCDSX-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