General Information of the Compound
| Compound ID |
CP0385004
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| Compound Name |
2-[3-[[2-(benzenesulfonyl)phenyl]methyl]imidazo[1,5-a]pyridin-1-yl]acetic acid
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| Structure |
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| Formula |
C22H18N2O4S
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| Molecular Weight |
406.463
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| Canonical SMILES |
OC(=O)Cc1nc(Cc2ccccc2S(=O)(=O)c2ccccc2)n2ccccc12
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| InChI |
InChI=1S/C22H18N2O4S/c25-22(26)15-18-19-11-6-7-13-24(19)21(23-18)14-16-8-4-5-12-20(16)29(27,28)17-9-2-1-3-10-17/h1-13H,14-15H2,(H,25,26)
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| InChIKey |
VRZUVXOFXHYEKI-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