General Information of the Compound
| Compound ID |
CP0959017
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| Compound Name |
5-(hydroxymethyl)-6-(4-methoxyphenyl)-4-methyl-2,3-diphenylpyrazolo[1,5-a]pyrimidin-7(4H)-one
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| Structure |
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| Formula |
C27H23N3O3
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| Molecular Weight |
437.499
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| Canonical SMILES |
COc1ccc(-c2c(CO)n(C)c3c(-c4ccccc4)c(-c4ccccc4)nn3c2=O)cc1
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| InChI |
InChI=1S/C27H23N3O3/c1-29-22(17-31)23(19-13-15-21(33-2)16-14-19)27(32)30-26(29)24(18-9-5-3-6-10-18)25(28-30)20-11-7-4-8-12-20/h3-16,31H,17H2,1-2H3
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| InChIKey |
OWOHTZWQNHIMQV-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