General Information of the Compound
| Compound ID |
CP0559104
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| Compound Name |
N-[[3-(cyclohexylmethoxy)phenyl]methyl]-4-methoxy-N-(pyridin-4-ylmethyl)benzamide
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| Structure |
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| Formula |
C28H32N2O3
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| Molecular Weight |
444.575
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| Canonical SMILES |
COc1ccc(cc1)C(=O)N(Cc1ccncc1)Cc1cccc(OCC2CCCCC2)c1
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| InChI |
InChI=1S/C28H32N2O3/c1-32-26-12-10-25(11-13-26)28(31)30(19-22-14-16-29-17-15-22)20-24-8-5-9-27(18-24)33-21-23-6-3-2-4-7-23/h5,8-18,23H,2-4,6-7,19-21H2,1H3
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| InChIKey |
VXGLUTQMWCVAHK-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