General Information of the Compound
| Compound ID |
CP0944950
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| Compound Name |
6-(4-methoxyphenyl)-5-(1-methyl-1H-imidazol-2-ylamino)-2,3-diphenylpyrazolo[1,5-a]pyrimidin-7(4H)-one
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| Formula |
C29H24N6O2
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| Molecular Weight |
488.551
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| Canonical SMILES |
COc1ccc(-c2c(Nc3nccn3C)[nH]c3c(-c4ccccc4)c(-c4ccccc4)nn3c2=O)cc1
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| InChI |
InChI=1S/C29H24N6O2/c1-34-18-17-30-29(34)32-26-24(20-13-15-22(37-2)16-14-20)28(36)35-27(31-26)23(19-9-5-3-6-10-19)25(33-35)21-11-7-4-8-12-21/h3-18,31H,1-2H3,(H,30,32)
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| InChIKey |
VKUJRVBDCBTZSF-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