General Information of the Compound
| Compound ID |
CP0437541
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| Compound Name |
N-cyclopentyl-2-[3-[6-propan-2-yl-4-[4-(1H-pyrazol-4-yl)anilino]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-yl]phenoxy]acetamide
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| Structure |
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| Formula |
C32H37N7O2
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| Molecular Weight |
551.695
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| Canonical SMILES |
CC(C)N1CCc2nc(nc(Nc3ccc(cc3)-c3cn[nH]c3)c2C1)-c1cccc(OCC(=O)NC2CCCC2)c1
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| InChI |
InChI=1S/C32H37N7O2/c1-21(2)39-15-14-29-28(19-39)32(36-26-12-10-22(11-13-26)24-17-33-34-18-24)38-31(37-29)23-6-5-9-27(16-23)41-20-30(40)35-25-7-3-4-8-25/h5-6,9-13,16-18,21,25H,3-4,7-8,14-15,19-20H2,1-2H3,(H,33,34)(H,35,40)(H,36,37,38)
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| InChIKey |
RPNZIAIYXIJPOI-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