General Information of the Compound
| Compound ID |
CP0549417
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| Compound Name |
4-[4-(2-methoxyphenyl)piperazin-1-yl]-1-(6-methoxypyridin-3-yl)pyrazolo[3,4-d]pyrimidine
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| Structure |
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| Formula |
C22H23N7O2
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| Molecular Weight |
417.473
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| Canonical SMILES |
COc1ccc(cn1)-n1ncc2c(ncnc12)N1CCN(CC1)c1ccccc1OC
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| InChI |
InChI=1S/C22H23N7O2/c1-30-19-6-4-3-5-18(19)27-9-11-28(12-10-27)21-17-14-26-29(22(17)25-15-24-21)16-7-8-20(31-2)23-13-16/h3-8,13-15H,9-12H2,1-2H3
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| InChIKey |
ULIFJDPCRNCCTC-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
Protein ID: PT04657, Solute carrier family 2, facilitated glucose transporter member 1
Protein ID: PT06387, Solute carrier family 2, facilitated glucose transporter member 3