General Information of the Compound
| Compound ID |
CP0096814
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| Compound Name |
5-Chloro-3-methyl-2-[3'-(methylsulfonyl)biphenyl-4-yl]quinoxaline
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| Structure |
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| Formula |
C22H17ClN2O2S
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| Molecular Weight |
408.91
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| Canonical SMILES |
Cc1nc2c(Cl)cccc2nc1-c1ccc(cc1)-c1cccc(c1)S(C)(=O)=O
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| InChI |
InChI=1S/C22H17ClN2O2S/c1-14-21(25-20-8-4-7-19(23)22(20)24-14)16-11-9-15(10-12-16)17-5-3-6-18(13-17)28(2,26)27/h3-13H,1-2H3
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| InChIKey |
MVLVWBZCSDBJRB-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