General Information of the Compound
| Compound ID |
CP0567134
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| Compound Name |
2-[1-(difluoromethyl)-6-oxopyridazin-3-yl]-8-[(2R)-2-hydroxy-2-(4-methyl-1-oxo-3H-2-benzofuran-5-yl)ethyl]-2,8-diazaspiro[4.5]decan-1-one
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| Structure |
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| Formula |
C24H26F2N4O5
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| Molecular Weight |
488.491
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| Canonical SMILES |
Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CCN(C2=O)c2ccc(=O)n(n2)C(F)F)CC1
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| InChI |
InChI=1S/C24H26F2N4O5/c1-14-15(2-3-16-17(14)13-35-21(16)33)18(31)12-28-9-6-24(7-10-28)8-11-29(22(24)34)19-4-5-20(32)30(27-19)23(25)26/h2-5,18,23,31H,6-13H2,1H3/t18-/m0/s1
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| InChIKey |
MPXVXIMSJGFFIT-SFHVURJKSA-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