General Information of the Compound
| Compound ID |
CP0948251
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| Compound Name |
5-methyl-6-(4-(methylsulfonyl)phenyl)-2-phenyl-3-(piperidin-1-yl)pyrazolo[1,5-a]pyrimidin-7(4H)-one
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| Formula |
C25H26N4O3S
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| Molecular Weight |
462.575
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| Canonical SMILES |
Cc1[nH]c2c(N3CCCCC3)c(-c3ccccc3)nn2c(=O)c1-c1ccc(S(C)(=O)=O)cc1
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| InChI |
InChI=1S/C25H26N4O3S/c1-17-21(18-11-13-20(14-12-18)33(2,31)32)25(30)29-24(26-17)23(28-15-7-4-8-16-28)22(27-29)19-9-5-3-6-10-19/h3,5-6,9-14,26H,4,7-8,15-16H2,1-2H3
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| InChIKey |
AARRBZMVLKEGIR-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