General Information of the Compound
| Compound ID |
CP0043424
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| Compound Name |
1-(3-(dimethylamino)propyl)-6-(4-ethoxy-3-(trifluoromethyl)phenyl)-1H-imidazo[4,5-c]pyridine-4-carbonitrile
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| Structure |
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| Formula |
C21H22F3N5O
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| Molecular Weight |
417.435
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| Canonical SMILES |
CCOc1ccc(cc1C(F)(F)F)-c1cc2n(CCCN(C)C)cnc2c(n1)C#N
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| InChI |
InChI=1S/C21H22F3N5O/c1-4-30-19-7-6-14(10-15(19)21(22,23)24)16-11-18-20(17(12-25)27-16)26-13-29(18)9-5-8-28(2)3/h6-7,10-11,13H,4-5,8-9H2,1-3H3
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| InChIKey |
BKFPUUQAFFNOOU-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