General Information of the Compound
| Compound ID |
CP0390388
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| Compound Name |
1-(oxan-4-yl)-3-pyridin-4-ylpyrrolo[2,3-c]pyridine
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| Structure |
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| Formula |
C17H17N3O
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| Molecular Weight |
279.343
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| Canonical SMILES |
C1CC(CCO1)n1cc(-c2ccncc2)c2ccncc12
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| InChI |
InChI=1S/C17H17N3O/c1-6-18-7-2-13(1)16-12-20(14-4-9-21-10-5-14)17-11-19-8-3-15(16)17/h1-3,6-8,11-12,14H,4-5,9-10H2
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| InChIKey |
NUTLDYDKKRBTHZ-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
Protein ID: PT01592, Dual specificity tyrosine-phosphorylation-regulated kinase 1A
Protein ID: PT00962, Glycogen synthase kinase-3 beta
Protein ID: PT00897, Potassium voltage-gated channel subfamily H member 2