General Information of the Compound
| Compound ID |
CP0567184
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| Compound Name |
1-[6-(5-fluoropyridin-3-yl)imidazo[1,2-b]pyridazin-3-yl]sulfonyl-4-phenylpiperidine-4-carbonitrile
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| Structure |
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| Formula |
C23H19FN6O2S
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| Molecular Weight |
462.51
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| Canonical SMILES |
Fc1cncc(c1)-c1ccc2ncc(n2n1)S(=O)(=O)N1CCC(CC1)(C#N)c1ccccc1
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| InChI |
InChI=1S/C23H19FN6O2S/c24-19-12-17(13-26-14-19)20-6-7-21-27-15-22(30(21)28-20)33(31,32)29-10-8-23(16-25,9-11-29)18-4-2-1-3-5-18/h1-7,12-15H,8-11H2
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| InChIKey |
OGJUFKWPPBAXPN-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