General Information of the Compound
| Compound ID |
CP0913642
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| Compound Name |
2-(4-methoxyphenyl)-5-methyl-3-phenyl-6-(quinolin-6-yl)pyrazolo[1,5-a]pyrimidin-7(4H)-one
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| Formula |
C29H22N4O2
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| Molecular Weight |
458.521
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| Canonical SMILES |
COc1ccc(-c2nn3c(=O)c(-c4ccc5ncccc5c4)c(C)[nH]c3c2-c2ccccc2)cc1
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| InChI |
InChI=1S/C29H22N4O2/c1-18-25(22-12-15-24-21(17-22)9-6-16-30-24)29(34)33-28(31-18)26(19-7-4-3-5-8-19)27(32-33)20-10-13-23(35-2)14-11-20/h3-17,31H,1-2H3
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| InChIKey |
NAMPKOJZRKRCQO-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