General Information of the Compound
| Compound ID |
CP0561248
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| Compound Name |
4-[6-[2-(3-fluorophenyl)piperidin-1-yl]imidazo[1,2-b]pyridazin-3-yl]benzonitrile
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| Structure |
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| Formula |
C24H20FN5
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| Molecular Weight |
397.457
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| Canonical SMILES |
Fc1cccc(c1)C1CCCCN1c1ccc2ncc(-c3ccc(cc3)C#N)n2n1
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| InChI |
InChI=1S/C24H20FN5/c25-20-5-3-4-19(14-20)21-6-1-2-13-29(21)24-12-11-23-27-16-22(30(23)28-24)18-9-7-17(15-26)8-10-18/h3-5,7-12,14,16,21H,1-2,6,13H2
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| InChIKey |
WJSPZKYFHWWSDK-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: PT01390, BDNF/NT-3 growth factors receptor
Protein ID: PT00934, High affinity nerve growth factor receptor
Protein ID: PT00936, NT-3 growth factor receptor