General Information of the Compound
| Compound ID |
CP0659782
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| Compound Name |
4-{[1-(6-Cyanopyridazin-3-yl)piperidin-4-yl]amino}-1Hpyrrolo[2,3-b]pyridine-5-carboxamide
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| Structure |
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| Formula |
C18H18N8O
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| Molecular Weight |
362.397
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| Canonical SMILES |
N#Cc1ccc(N2CCC(Nc3c(C(N)=O)cnc4[nH]ccc34)CC2)nn1
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| InChI |
InChI=1S/C18H18N8O/c19-9-12-1-2-15(25-24-12)26-7-4-11(5-8-26)23-16-13-3-6-21-18(13)22-10-14(16)17(20)27/h1-3,6,10-11H,4-5,7-8H2,(H2,20,27)(H2,21,22,23)
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| InChIKey |
WEAYOCOHYLCUOF-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