General Information of the Compound
| Compound ID |
CP0133924
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| Compound Name |
N-[5-(7-methoxyquinolin-4-yl)oxypyridin-2-yl]-1-methyl-3-oxo-2-phenyl-5-(pyrrolidin-1-ylmethyl)pyrazole-4-carboxamide
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| Structure |
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| Formula |
C31H30N6O4
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| Molecular Weight |
550.619
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| Canonical SMILES |
COc1ccc2c(Oc3ccc(NC(=O)c4c(CN5CCCC5)n(C)n(-c5ccccc5)c4=O)nc3)ccnc2c1
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| InChI |
InChI=1S/C31H30N6O4/c1-35-26(20-36-16-6-7-17-36)29(31(39)37(35)21-8-4-3-5-9-21)30(38)34-28-13-11-23(19-33-28)41-27-14-15-32-25-18-22(40-2)10-12-24(25)27/h3-5,8-15,18-19H,6-7,16-17,20H2,1-2H3,(H,33,34,38)
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| InChIKey |
GODJFMYOWZKKJA-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