General Information of the Compound
| Compound ID |
CP0566595
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| Compound Name |
N-[(3-fluorophenyl)methyl]-2-[5-[4-(2-morpholin-4-ylethoxy)phenyl]pyridin-2-yl]acetamide
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| Structure |
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| Formula |
C26H28FN3O3
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| Molecular Weight |
449.526
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| Canonical SMILES |
Fc1cccc(CNC(=O)Cc2ccc(cn2)-c2ccc(OCCN3CCOCC3)cc2)c1
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| InChI |
InChI=1S/C26H28FN3O3/c27-23-3-1-2-20(16-23)18-29-26(31)17-24-7-4-22(19-28-24)21-5-8-25(9-6-21)33-15-12-30-10-13-32-14-11-30/h1-9,16,19H,10-15,17-18H2,(H,29,31)
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| InChIKey |
ILPCNFQONRTMBO-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