General Information of the Compound
| Compound ID |
CP0841492
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| Compound Name |
3-(4-((4-Cyanopiperidin-1-yl)methyl)phenyl)-9H-pyrrolo[2,3-b:5,4-c']dipyridine-6-carbonitrile
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| Structure |
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| Formula |
C24H20N6
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| Molecular Weight |
392.466
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| Canonical SMILES |
N#Cc1cc2c(cn1)[nH]c1ncc(-c3ccc(CN4CCC(C#N)CC4)cc3)cc12
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| InChI |
InChI=1S/C24H20N6/c25-11-16-5-7-30(8-6-16)15-17-1-3-18(4-2-17)19-9-22-21-10-20(12-26)27-14-23(21)29-24(22)28-13-19/h1-4,9-10,13-14,16H,5-8,15H2,(H,28,29)
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| InChIKey |
JSXCSUSMRGBMGM-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