General Information of the Compound
| Compound ID |
CP0493971
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| Compound Name |
N-[2-(2-bromoethoxy)phenyl]-2-[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxyacetamide
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| Structure |
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| Formula |
C20H30BrNO3
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| Molecular Weight |
412.368
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| Canonical SMILES |
CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OCC(=O)Nc1ccccc1OCCBr
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| InChI |
InChI=1S/C20H30BrNO3/c1-14(2)16-9-8-15(3)12-19(16)25-13-20(23)22-17-6-4-5-7-18(17)24-11-10-21/h4-7,14-16,19H,8-13H2,1-3H3,(H,22,23)/t15-,16+,19-/m1/s1
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| InChIKey |
GUQGHSLXSOGCEK-JTDSTZFVSA-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