General Information of the Compound
| Compound ID |
CP0502279
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| Compound Name |
3-cyano-N-(3-(3-methoxyphenyl)-6-(piperidine-1-carbonyl)-3H-imidazo[4,5-b]pyridin-2-yl)benzamide
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| Structure |
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| Formula |
C27H24N6O3
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| Molecular Weight |
480.528
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| Canonical SMILES |
COc1cccc(c1)-n1c(NC(=O)c2cccc(c2)C#N)nc2cc(cnc12)C(=O)N1CCCCC1
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| InChI |
InChI=1S/C27H24N6O3/c1-36-22-10-6-9-21(15-22)33-24-23(14-20(17-29-24)26(35)32-11-3-2-4-12-32)30-27(33)31-25(34)19-8-5-7-18(13-19)16-28/h5-10,13-15,17H,2-4,11-12H2,1H3,(H,30,31,34)
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| InChIKey |
IKYDCWPNZBDRTP-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