General Information of the Compound
| Compound ID |
CP0406442
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| Compound Name |
N-(3-aminocyclohexyl)-2-[(2-cyanophenyl)methoxy]-N-ethylbenzamide
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| Structure |
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| Formula |
C23H27N3O2
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| Molecular Weight |
377.488
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| Canonical SMILES |
CCN(C1CCCC(N)C1)C(=O)c1ccccc1OCc1ccccc1C#N
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| InChI |
InChI=1S/C23H27N3O2/c1-2-26(20-11-7-10-19(25)14-20)23(27)21-12-5-6-13-22(21)28-16-18-9-4-3-8-17(18)15-24/h3-6,8-9,12-13,19-20H,2,7,10-11,14,16,25H2,1H3
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| InChIKey |
OLIMDZCNNKRFFE-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