General Information of the Compound
| Compound ID |
CP0437045
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| Compound Name |
4-((5-(6-methylpyridin-2-yl)-4-(quinoxalin-6-yl)-1H-imidazol-2-yl)methylamino)benzonitrile
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| Structure |
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| Formula |
C25H19N7
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| Molecular Weight |
417.476
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| Canonical SMILES |
Cc1cccc(n1)-c1nc(CNc2ccc(cc2)C#N)[nH]c1-c1ccc2nccnc2c1
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| InChI |
InChI=1S/C25H19N7/c1-16-3-2-4-21(30-16)25-24(18-7-10-20-22(13-18)28-12-11-27-20)31-23(32-25)15-29-19-8-5-17(14-26)6-9-19/h2-13,29H,15H2,1H3,(H,31,32)
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| InChIKey |
YNLCYWYBNGLRAZ-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