General Information of the Compound
| Compound ID |
CP0938734
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| Compound Name |
3-(4-((5-chloro-2-oxopyridin-1(2H)-yl)methyl)piperidin-1-yl)-2-(cyclopropylamino)quinoxaline-6-carbonitrile
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| Structure |
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| Formula |
C23H23ClN6O
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| Molecular Weight |
434.931
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| Canonical SMILES |
N#Cc1ccc2nc(NC3CC3)c(N3CCC(Cn4cc(Cl)ccc4=O)CC3)nc2c1
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| InChI |
InChI=1S/C23H23ClN6O/c24-17-2-6-21(31)30(14-17)13-15-7-9-29(10-8-15)23-22(26-18-3-4-18)27-19-5-1-16(12-25)11-20(19)28-23/h1-2,5-6,11,14-15,18H,3-4,7-10,13H2,(H,26,27)
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| InChIKey |
ANGGFHMLEYLBFG-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