General Information of the Compound
| Compound ID |
CP0174365
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| Compound Name |
N-[3-[1-[4-oxo-4-(4-phenoxyphenyl)butyl]piperidin-4-yl]phenyl]acetamide
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| Structure |
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| Formula |
C29H32N2O3
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| Molecular Weight |
456.586
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| Canonical SMILES |
CC(=O)Nc1cccc(c1)C1CCN(CCCC(=O)c2ccc(Oc3ccccc3)cc2)CC1
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| InChI |
InChI=1S/C29H32N2O3/c1-22(32)30-26-8-5-7-25(21-26)23-16-19-31(20-17-23)18-6-11-29(33)24-12-14-28(15-13-24)34-27-9-3-2-4-10-27/h2-5,7-10,12-15,21,23H,6,11,16-20H2,1H3,(H,30,32)
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| InChIKey |
HKIBDKKNDIBQNU-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