General Information of the Compound
| Compound ID |
CP0552129
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| Compound Name |
6-[(5-cyanopyrazin-2-yl)amino]-N-phenyl-4-(piperidin-4-ylmethylamino)pyridine-3-carboxamide
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| Structure |
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| Formula |
C23H24N8O
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| Molecular Weight |
428.5
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| Canonical SMILES |
O=C(Nc1ccccc1)c1cnc(Nc2cnc(cn2)C#N)cc1NCC1CCNCC1
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| InChI |
InChI=1S/C23H24N8O/c24-11-18-13-28-22(15-26-18)31-21-10-20(27-12-16-6-8-25-9-7-16)19(14-29-21)23(32)30-17-4-2-1-3-5-17/h1-5,10,13-16,25H,6-9,12H2,(H,30,32)(H2,27,28,29,31)
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| InChIKey |
OHPLTMNJIZQXSC-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