General Information of the Compound
| Compound ID |
CP0899451
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| Compound Name |
1-{4-[2-(4-Chloro-phenyl)-6-(1,1-dioxo-1lambda(6)-isothiazolidin-2-yl)-imidazo[1,2-a]pyridin-3-ylmethyl]-piperazin-1-yl}-ethanone
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| Structure |
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| Formula |
C23H26ClN5O3S
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| Molecular Weight |
488.013
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| Canonical SMILES |
CC(=O)N1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(N4CCCS4(=O)=O)cn23)CC1
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| InChI |
InChI=1S/C23H26ClN5O3S/c1-17(30)27-12-10-26(11-13-27)16-21-23(18-3-5-19(24)6-4-18)25-22-8-7-20(15-28(21)22)29-9-2-14-33(29,31)32/h3-8,15H,2,9-14,16H2,1H3
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| InChIKey |
MDSQCKBWOIQCCP-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: PT06319, Solute carrier family 2, facilitated glucose transporter member 2