General Information of the Compound
| Compound ID |
CP0411515
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| Compound Name |
N-[2-[3-[[5-[3-(dimethylcarbamoyl)phenyl]-2-methoxyphenyl]sulfonylamino]anilino]ethyl]-2-methylbenzamide
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| Structure |
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| Formula |
C32H34N4O5S
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| Molecular Weight |
586.714
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| Canonical SMILES |
COc1ccc(cc1S(=O)(=O)Nc1cccc(NCCNC(=O)c2ccccc2C)c1)-c1cccc(c1)C(=O)N(C)C
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| InChI |
InChI=1S/C32H34N4O5S/c1-22-9-5-6-14-28(22)31(37)34-18-17-33-26-12-8-13-27(21-26)35-42(39,40)30-20-24(15-16-29(30)41-4)23-10-7-11-25(19-23)32(38)36(2)3/h5-16,19-21,33,35H,17-18H2,1-4H3,(H,34,37)
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| InChIKey |
BCAZTROQQPZQEL-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