General Information of the Compound
| Compound ID |
CP0392873
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| Compound Name |
4-methoxy-N-[[3-(oxan-4-ylmethoxy)phenyl]methyl]-N-(pyridin-4-ylmethyl)benzamide
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| Structure |
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| Formula |
C27H30N2O4
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| Molecular Weight |
446.547
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| Canonical SMILES |
COc1ccc(cc1)C(=O)N(Cc1ccncc1)Cc1cccc(OCC2CCOCC2)c1
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| InChI |
InChI=1S/C27H30N2O4/c1-31-25-7-5-24(6-8-25)27(30)29(18-21-9-13-28-14-10-21)19-23-3-2-4-26(17-23)33-20-22-11-15-32-16-12-22/h2-10,13-14,17,22H,11-12,15-16,18-20H2,1H3
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| InChIKey |
ARSHGCBSHPVUDZ-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