General Information of the Compound
| Compound ID |
CP0136859
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| Compound Name |
N-[2-(1-benzylpiperidin-4-yl)ethyl]-5,7-dihydroxy-4-oxochromene-2-carboxamide
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| Structure |
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| Formula |
C24H26N2O5
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| Molecular Weight |
422.481
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| Canonical SMILES |
Oc1cc(O)c2c(c1)oc(cc2=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1
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| InChI |
InChI=1S/C24H26N2O5/c27-18-12-19(28)23-20(29)14-22(31-21(23)13-18)24(30)25-9-6-16-7-10-26(11-8-16)15-17-4-2-1-3-5-17/h1-5,12-14,16,27-28H,6-11,15H2,(H,25,30)
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| InChIKey |
JJLKMCMOKOTMJV-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