General Information of the Compound
| Compound ID |
CP0684741
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| Compound Name |
4-{[1-(5-Cyanopyridin-2-yl)piperidin-4-yl]amino}-1Hpyrrolo[2,3-b]pyridine-5-carboxamide
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| Structure |
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| Formula |
C19H19N7O
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| Molecular Weight |
361.409
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| Canonical SMILES |
N#Cc1ccc(N2CCC(Nc3c(C(N)=O)cnc4[nH]ccc34)CC2)nc1
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| InChI |
InChI=1S/C19H19N7O/c20-9-12-1-2-16(23-10-12)26-7-4-13(5-8-26)25-17-14-3-6-22-19(14)24-11-15(17)18(21)27/h1-3,6,10-11,13H,4-5,7-8H2,(H2,21,27)(H2,22,24,25)
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| InChIKey |
XFSMWLHLZSVJAB-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