General Information of the Compound
| Compound ID |
CP0552195
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| Compound Name |
1-(3-chlorophenyl)sulfonyl-2-phenyl-4-piperazin-1-ylimidazo[4,5-c]pyridine
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| Formula |
C22H20ClN5O2S
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| Molecular Weight |
453.955
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| Canonical SMILES |
Clc1cccc(c1)S(=O)(=O)n1c(nc2c(nccc12)N1CCNCC1)-c1ccccc1
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| InChI |
InChI=1S/C22H20ClN5O2S/c23-17-7-4-8-18(15-17)31(29,30)28-19-9-10-25-22(27-13-11-24-12-14-27)20(19)26-21(28)16-5-2-1-3-6-16/h1-10,15,24H,11-14H2
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| InChIKey |
JHVGQSBTPJECOW-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