General Information of the Compound
| Compound ID |
CP0065879
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| Compound Name |
1-(3-methylbutyl)-4-[4-(2-methylpyridin-4-yl)oxyphenyl]-2-oxopyridine-3-carbonitrile
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| Structure |
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| Formula |
C23H23N3O2
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| Molecular Weight |
373.456
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| Canonical SMILES |
CC(C)CCn1ccc(-c2ccc(Oc3ccnc(C)c3)cc2)c(C#N)c1=O
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| InChI |
InChI=1S/C23H23N3O2/c1-16(2)9-12-26-13-10-21(22(15-24)23(26)27)18-4-6-19(7-5-18)28-20-8-11-25-17(3)14-20/h4-8,10-11,13-14,16H,9,12H2,1-3H3
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| InChIKey |
GAXYDHPYPPPJHR-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