General Information of the Compound
| Compound ID |
CP0963553
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| Compound Name |
5-((1H-pyrazol-1-yl)methyl)-2,3-diphenyl-6-(quinolin-6-yl)pyrazolo[1,5-a]pyrimidin-7(4H)-one
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| Formula |
C31H22N6O
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| Molecular Weight |
494.558
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| Canonical SMILES |
O=c1c(-c2ccc3ncccc3c2)c(Cn2cccn2)[nH]c2c(-c3ccccc3)c(-c3ccccc3)nn12
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| InChI |
InChI=1S/C31H22N6O/c38-31-27(24-14-15-25-23(19-24)13-7-16-32-25)26(20-36-18-8-17-33-36)34-30-28(21-9-3-1-4-10-21)29(35-37(30)31)22-11-5-2-6-12-22/h1-19,34H,20H2
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| InChIKey |
USBBZUANHQRLHJ-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