General Information of the Compound
| Compound ID |
CP0505142
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| Compound Name |
5-fluoro-1-[1-[6-(1-methylpyrazol-4-yl)pyridazin-3-yl]piperidin-4-yl]-2,3-dihydroindole
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| Structure |
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| Formula |
C21H23FN6
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| Molecular Weight |
378.455
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| Canonical SMILES |
Cn1cc(cn1)-c1ccc(nn1)N1CCC(CC1)N1CCc2cc(F)ccc12
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| InChI |
InChI=1S/C21H23FN6/c1-26-14-16(13-23-26)19-3-5-21(25-24-19)27-9-7-18(8-10-27)28-11-6-15-12-17(22)2-4-20(15)28/h2-5,12-14,18H,6-11H2,1H3
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| InChIKey |
IQQQMAUGJKASHW-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