General Information of the Compound
| Compound ID |
CP0903287
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| Compound Name |
N-(3,4-dimethoxybenzyl)-1-((2'-(N-(3,4-dimethylisoxazol-5-yl)sulfamoyl)-[1,1'-biphenyl]-4-yl)methyl)-4-methyl-2-propyl-1H-benzo[d]imidazole-6-carboxamide
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| Structure |
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| Formula |
C39H41N5O6S
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| Molecular Weight |
707.853
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| Canonical SMILES |
CCCc1nc2c(C)cc(C(=O)NCc3ccc(OC)c(OC)c3)cc2n1Cc1ccc(-c2ccccc2S(=O)(=O)Nc2onc(C)c2C)cc1
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| InChI |
InChI=1S/C39H41N5O6S/c1-7-10-36-41-37-24(2)19-30(38(45)40-22-28-15-18-33(48-5)34(20-28)49-6)21-32(37)44(36)23-27-13-16-29(17-14-27)31-11-8-9-12-35(31)51(46,47)43-39-25(3)26(4)42-50-39/h8-9,11-21,43H,7,10,22-23H2,1-6H3,(H,40,45)
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| InChIKey |
WJNVIBVADFEWGY-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