General Information of the Compound
| Compound ID |
CP0910019
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| Compound Name |
5-((6-aminopyridazin-3-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 |
C29H23N7O2
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| Molecular Weight |
501.55
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| Canonical SMILES |
COc1ccc(-c2c(Nc3ccc(N)nn3)[nH]c3c(-c4ccccc4)c(-c4ccccc4)nn3c2=O)cc1
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| InChI |
InChI=1S/C29H23N7O2/c1-38-21-14-12-19(13-15-21)25-27(31-23-17-16-22(30)33-34-23)32-28-24(18-8-4-2-5-9-18)26(35-36(28)29(25)37)20-10-6-3-7-11-20/h2-17,32H,1H3,(H2,30,33)(H,31,34)
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| InChIKey |
BNOZGSIUGXEYPP-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