General Information of the Compound
| Compound ID |
CP0635723
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| Compound Name |
2',4'-Dichloro-5-(isobutyryl-methyl-amino)-biphenyl-3-carboxylic acid((R)-2-methoxy-1-methyl-ethyl)-amide
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| Structure |
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| Formula |
C22H26Cl2N2O3
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| Molecular Weight |
437.367
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| Canonical SMILES |
COC[C@@H](C)NC(=O)c1cc(-c2ccc(Cl)cc2Cl)cc(N(C)C(=O)C(C)C)c1
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| InChI |
InChI=1S/C22H26Cl2N2O3/c1-13(2)22(28)26(4)18-9-15(19-7-6-17(23)11-20(19)24)8-16(10-18)21(27)25-14(3)12-29-5/h6-11,13-14H,12H2,1-5H3,(H,25,27)/t14-/m1/s1
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| InChIKey |
IHWQDTBBORRHEX-CQSZACIVSA-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