General Information of the Compound
| Compound ID |
CP0915911
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| Compound Name |
6-((6-(4-methoxyphenyl)-7-oxo-2,3-diphenyl-4,7-dihydropyrazolo[1,5-a]pyrimidin-5-yl)amino)picolinamide
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| Structure |
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| Formula |
C31H24N6O3
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| Molecular Weight |
528.572
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| Canonical SMILES |
COc1ccc(-c2c(Nc3cccc(C(N)=O)n3)[nH]c3c(-c4ccccc4)c(-c4ccccc4)nn3c2=O)cc1
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| InChI |
InChI=1S/C31H24N6O3/c1-40-22-17-15-20(16-18-22)26-29(34-24-14-8-13-23(33-24)28(32)38)35-30-25(19-9-4-2-5-10-19)27(36-37(30)31(26)39)21-11-6-3-7-12-21/h2-18,35H,1H3,(H2,32,38)(H,33,34)
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| InChIKey |
LHKWEPKIVTZYMR-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