General Information of the Compound
| Compound ID |
CP0447201
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| Compound Name |
8-[(1R,2S)-1-hydroxy-1-(4-methyl-1-oxo-3H-2-benzofuran-5-yl)propan-2-yl]-2-(1-methyl-6-oxopyridazin-3-yl)-2,8-diazaspiro[4.5]decan-1-one
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| Structure |
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| Formula |
C25H30N4O5
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| Molecular Weight |
466.538
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| Canonical SMILES |
C[C@@H]([C@H](O)c1ccc2C(=O)OCc2c1C)N1CCC2(CCN(C2=O)c2ccc(=O)n(C)n2)CC1
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| InChI |
InChI=1S/C25H30N4O5/c1-15-17(4-5-18-19(15)14-34-23(18)32)22(31)16(2)28-11-8-25(9-12-28)10-13-29(24(25)33)20-6-7-21(30)27(3)26-20/h4-7,16,22,31H,8-14H2,1-3H3/t16-,22-/m0/s1
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| InChIKey |
JICUUUBHBGKHQQ-AOMKIAJQSA-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