General Information of the Compound
| Compound ID |
CP0862997
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| Compound Name |
6-(3-(1-(5-isopropyl-1,2,4-oxadiazol-3-yl)piperidin-4-yl)propylamino)benzofuran-3(2H)-one
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| Structure |
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| Formula |
C21H28N4O3
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| Molecular Weight |
384.48
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| Canonical SMILES |
CC(C)c1nc(N2CCC(CCCNc3ccc4c(c3)OCC4=O)CC2)no1
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| InChI |
InChI=1S/C21H28N4O3/c1-14(2)20-23-21(24-28-20)25-10-7-15(8-11-25)4-3-9-22-16-5-6-17-18(26)13-27-19(17)12-16/h5-6,12,14-15,22H,3-4,7-11,13H2,1-2H3
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| InChIKey |
PMDACOFLLOSGMY-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