General Information of the Compound
| Compound ID |
CP0432921
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| Compound Name |
6-fluoro-1-[1-[6-(1-methylpyrazol-4-yl)pyridazin-3-yl]piperidin-4-yl]indazole
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| Structure |
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| Formula |
C20H20FN7
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| Molecular Weight |
377.427
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| Canonical SMILES |
Cn1cc(cn1)-c1ccc(nn1)N1CCC(CC1)n1ncc2ccc(F)cc12
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| InChI |
InChI=1S/C20H20FN7/c1-26-13-15(12-22-26)18-4-5-20(25-24-18)27-8-6-17(7-9-27)28-19-10-16(21)3-2-14(19)11-23-28/h2-5,10-13,17H,6-9H2,1H3
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| InChIKey |
DFAAZTGEFUDAJO-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