General Information of the Compound
| Compound ID |
CP0914119
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| Compound Name |
2-(3-(4-((4-(1H-Pyrazol-4-yl)phenyl)amino)-6-(tetrahydrofuran-3-yl)-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)phenoxy)-N-(tert-butyl)acetamide
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| Structure |
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| Formula |
C32H37N7O3
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| Molecular Weight |
567.694
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| Canonical SMILES |
CC(C)(C)NC(=O)COc1cccc(-c2nc3c(c(Nc4ccc(-c5cn[nH]c5)cc4)n2)CN(C2CCOC2)CC3)c1
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| InChI |
InChI=1S/C32H37N7O3/c1-32(2,3)38-29(40)20-42-26-6-4-5-22(15-26)30-36-28-11-13-39(25-12-14-41-19-25)18-27(28)31(37-30)35-24-9-7-21(8-10-24)23-16-33-34-17-23/h4-10,15-17,25H,11-14,18-20H2,1-3H3,(H,33,34)(H,38,40)(H,35,36,37)
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| InChIKey |
HNFXFISXXNEMAC-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