General Information of the Compound
| Compound ID |
CP0468973
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| Compound Name |
2-(3-cyanobenzamido)-3-(3-methoxypropyl)-N,N-dimethyl-3H-imidazo[4,5-b]pyridine-6-carboxamide
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| Structure |
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| Formula |
C21H22N6O3
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| Molecular Weight |
406.446
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| Canonical SMILES |
COCCCn1c(NC(=O)c2cccc(c2)C#N)nc2cc(cnc12)C(=O)N(C)C
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| InChI |
InChI=1S/C21H22N6O3/c1-26(2)20(29)16-11-17-18(23-13-16)27(8-5-9-30-3)21(24-17)25-19(28)15-7-4-6-14(10-15)12-22/h4,6-7,10-11,13H,5,8-9H2,1-3H3,(H,24,25,28)
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| InChIKey |
RBAOLDGIUFILHC-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