General Information of the Compound
| Compound ID |
CP0529719
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| Compound Name |
3-cyano-N-(3-pentyl-6-(piperidine-1-carbonyl)-3H-imidazo[4,5-b]pyridin-2-yl)benzamide
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| Structure |
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| Formula |
C25H28N6O2
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| Molecular Weight |
444.539
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| Canonical SMILES |
CCCCCn1c(NC(=O)c2cccc(c2)C#N)nc2cc(cnc12)C(=O)N1CCCCC1
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| InChI |
InChI=1S/C25H28N6O2/c1-2-3-5-13-31-22-21(15-20(17-27-22)24(33)30-11-6-4-7-12-30)28-25(31)29-23(32)19-10-8-9-18(14-19)16-26/h8-10,14-15,17H,2-7,11-13H2,1H3,(H,28,29,32)
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| InChIKey |
DKWNMYDVXCDZAI-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