General Information of the Compound
| Compound ID |
CP0546170
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| Compound Name |
3-[6-(1-acetylazetidin-3-yl)oxy-7-(1-methylpyrazol-4-yl)imidazo[1,2-b]pyridazin-3-yl]-N-methylbenzamide
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| Formula |
C23H23N7O3
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| Molecular Weight |
445.483
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| Canonical SMILES |
CNC(=O)c1cccc(c1)-c1cnc2cc(-c3cnn(C)c3)c(OC3CN(C3)C(C)=O)nn12
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| InChI |
InChI=1S/C23H23N7O3/c1-14(31)29-12-18(13-29)33-23-19(17-9-26-28(3)11-17)8-21-25-10-20(30(21)27-23)15-5-4-6-16(7-15)22(32)24-2/h4-11,18H,12-13H2,1-3H3,(H,24,32)
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| InChIKey |
MMCIUMOGDVOFIZ-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