General Information of the Compound
| Compound ID |
CP0144048
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| Compound Name |
N-[3-(1-benzylpiperidin-4-yl)propyl]-6-methoxy-4-oxochromene-2-carboxamide
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| Structure |
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| Formula |
C26H30N2O4
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| Molecular Weight |
434.536
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| Canonical SMILES |
COc1ccc2oc(cc(=O)c2c1)C(=O)NCCCC1CCN(Cc2ccccc2)CC1
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| InChI |
InChI=1S/C26H30N2O4/c1-31-21-9-10-24-22(16-21)23(29)17-25(32-24)26(30)27-13-5-8-19-11-14-28(15-12-19)18-20-6-3-2-4-7-20/h2-4,6-7,9-10,16-17,19H,5,8,11-15,18H2,1H3,(H,27,30)
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| InChIKey |
PPHUUQGGAWURKS-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