General Information of the Compound
| Compound ID |
CP0962510
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| Compound Name |
N-(2-(4-benzylpiperidin-1-yl)-5-cyanopyridin-3-yl)picolinamide
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| Structure |
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| Formula |
C23H21N5O2
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| Molecular Weight |
399.454
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| Canonical SMILES |
N#Cc1cnc(N2CCC(Oc3ccccc3)CC2)c(NC(=O)c2ccccn2)c1
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| InChI |
InChI=1S/C23H21N5O2/c24-15-17-14-21(27-23(29)20-8-4-5-11-25-20)22(26-16-17)28-12-9-19(10-13-28)30-18-6-2-1-3-7-18/h1-8,11,14,16,19H,9-10,12-13H2,(H,27,29)
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| InChIKey |
LGHULQNYWPCATG-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