General Information of the Compound
| Compound ID |
CP0467719
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| Compound Name |
2-[[cyclohexyl-(3,5-dichlorophenyl)sulfonylamino]methyl]-5-(naphthalen-2-ylmethyl)-1H-imidazole-4-carboxylic acid
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| Structure |
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| Formula |
C28H27Cl2N3O4S
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| Molecular Weight |
572.514
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| Canonical SMILES |
OC(=O)c1nc(CN(C2CCCCC2)S(=O)(=O)c2cc(Cl)cc(Cl)c2)[nH]c1Cc1ccc2ccccc2c1
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| InChI |
InChI=1S/C28H27Cl2N3O4S/c29-21-14-22(30)16-24(15-21)38(36,37)33(23-8-2-1-3-9-23)17-26-31-25(27(32-26)28(34)35)13-18-10-11-19-6-4-5-7-20(19)12-18/h4-7,10-12,14-16,23H,1-3,8-9,13,17H2,(H,31,32)(H,34,35)
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| InChIKey |
STOFABAKBJPYPQ-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