General Information of the Compound
| Compound ID |
CP0125948
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| Compound Name |
N-[2-methoxy-4-(7-methoxyquinolin-4-yl)oxyphenyl]-1,5-dimethyl-3-oxo-2-phenylpyrazole-4-carboxamide
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| Structure |
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| Formula |
C29H26N4O5
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| Molecular Weight |
510.55
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| Canonical SMILES |
COc1ccc2c(Oc3ccc(NC(=O)c4c(C)n(C)n(-c5ccccc5)c4=O)c(OC)c3)ccnc2c1
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| InChI |
InChI=1S/C29H26N4O5/c1-18-27(29(35)33(32(18)2)19-8-6-5-7-9-19)28(34)31-23-13-11-21(17-26(23)37-4)38-25-14-15-30-24-16-20(36-3)10-12-22(24)25/h5-17H,1-4H3,(H,31,34)
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| InChIKey |
JZMKNOWKNYJUOM-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