General Information of the Compound
| Compound ID |
CP0339654
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| Compound Name |
N-[1-(1,3-benzodioxol-5-ylmethyl)piperidin-4-yl]-6-methyl-4-oxochromene-2-carboxamide
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| Structure |
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| Formula |
C24H24N2O5
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| Molecular Weight |
420.465
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| Canonical SMILES |
Cc1ccc2oc(cc(=O)c2c1)C(=O)NC1CCN(Cc2ccc3OCOc3c2)CC1
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| InChI |
InChI=1S/C24H24N2O5/c1-15-2-4-20-18(10-15)19(27)12-23(31-20)24(28)25-17-6-8-26(9-7-17)13-16-3-5-21-22(11-16)30-14-29-21/h2-5,10-12,17H,6-9,13-14H2,1H3,(H,25,28)
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| InChIKey |
SKWDDWRKVKEFIC-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