General Information of the Compound
| Compound ID |
CP0547102
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| Compound Name |
8-[(2R)-2-hydroxy-2-(4-methyl-1-oxo-3H-2-benzofuran-5-yl)ethyl]-2-(2-methyl-5-oxo-2H-furan-3-yl)-2,8-diazaspiro[4.5]decan-1-one
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| Structure |
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| Formula |
C24H28N2O6
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| Molecular Weight |
440.496
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| Canonical SMILES |
CC1OC(=O)C=C1N1CCC2(CCN(C[C@H](O)c3ccc4C(=O)OCc4c3C)CC2)C1=O
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| InChI |
InChI=1S/C24H28N2O6/c1-14-16(3-4-17-18(14)13-31-22(17)29)20(27)12-25-8-5-24(6-9-25)7-10-26(23(24)30)19-11-21(28)32-15(19)2/h3-4,11,15,20,27H,5-10,12-13H2,1-2H3/t15?,20-/m0/s1
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| InChIKey |
YTPYVSHGPFPSMP-MBABXSBOSA-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
Protein ID: PT03667, ATP-sensitive inward rectifier potassium channel 1
Protein ID: PT00897, Potassium voltage-gated channel subfamily H member 2