General Information of the Compound
| Compound ID |
CP0905386
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| Compound Name |
3-((4-(ethylsulfonyl)piperazin-1-yl)methyl)-2-(3-nitrophenyl)-6-phenylimidazo[1,2-a]pyridine
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| Structure |
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| Formula |
C26H27N5O4S
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| Molecular Weight |
505.6
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| Canonical SMILES |
CCS(=O)(=O)N1CCN(Cc2c(-c3cccc([N+](=O)[O-])c3)nc3ccc(-c4ccccc4)cn23)CC1
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| InChI |
InChI=1S/C26H27N5O4S/c1-2-36(34,35)29-15-13-28(14-16-29)19-24-26(21-9-6-10-23(17-21)31(32)33)27-25-12-11-22(18-30(24)25)20-7-4-3-5-8-20/h3-12,17-18H,2,13-16,19H2,1H3
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| InChIKey |
GTOJNDBICFELBO-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