General Information of the Compound
| Compound ID |
CP0968283
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| Compound Name |
5-((1H-pyrrolo[2,3-c]pyridin-5-yl)amino)-6-(4-methoxyphenyl)-2,3-diphenylpyrazolo[1,5-a]pyrimidin-7(4H)-one
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| Structure |
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| Formula |
C32H24N6O2
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| Molecular Weight |
524.584
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| Canonical SMILES |
COc1ccc(-c2c(Nc3cc4cc[nH]c4cn3)[nH]c3c(-c4ccccc4)c(-c4ccccc4)nn3c2=O)cc1
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| InChI |
InChI=1S/C32H24N6O2/c1-40-24-14-12-21(13-15-24)28-30(35-26-18-23-16-17-33-25(23)19-34-26)36-31-27(20-8-4-2-5-9-20)29(37-38(31)32(28)39)22-10-6-3-7-11-22/h2-19,33,36H,1H3,(H,34,35)
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| InChIKey |
ZWXMNHOSVIJLLI-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