General Information of the Compound
| Compound ID |
CP0076589
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| Compound Name |
N-[[4-(2-methylpropylsulfamoyl)phenyl]carbamothioyl]-4-phenylbenzamide
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| Structure |
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| Formula |
C24H25N3O3S2
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| Molecular Weight |
467.616
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| Canonical SMILES |
CC(C)CNS(=O)(=O)c1ccc(NC(=S)NC(=O)c2ccc(cc2)-c2ccccc2)cc1
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| InChI |
InChI=1S/C24H25N3O3S2/c1-17(2)16-25-32(29,30)22-14-12-21(13-15-22)26-24(31)27-23(28)20-10-8-19(9-11-20)18-6-4-3-5-7-18/h3-15,17,25H,16H2,1-2H3,(H2,26,27,28,31)
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| InChIKey |
ZPBPMWGVRDLURO-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