General Information of the Compound
| Compound ID |
CP0689009
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| Compound Name |
3-(4-((4-Fluoropiperidin-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 |
C23H20FN5
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| Molecular Weight |
385.446
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| Canonical SMILES |
N#Cc1cc2c(cn1)[nH]c1ncc(-c3ccc(CN4CCC(F)CC4)cc3)cc12
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| InChI |
InChI=1S/C23H20FN5/c24-18-5-7-29(8-6-18)14-15-1-3-16(4-2-15)17-9-21-20-10-19(11-25)26-13-22(20)28-23(21)27-12-17/h1-4,9-10,12-13,18H,5-8,14H2,(H,27,28)
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| InChIKey |
TUYLVERIWIAINX-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