General Information of the Compound
| Compound ID |
CP0020431
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| Compound Name |
2-[4-[1-(1-acetylpiperidin-4-yl)pyrazol-4-yl]-7-aminofuro[2,3-c]pyridin-2-yl]benzonitrile
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| Structure |
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| Formula |
C24H22N6O2
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| Molecular Weight |
426.48
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| Canonical SMILES |
CC(=O)N1CCC(CC1)n1cc(cn1)-c1cnc(N)c2oc(cc12)-c1ccccc1C#N
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| InChI |
InChI=1S/C24H22N6O2/c1-15(31)29-8-6-18(7-9-29)30-14-17(12-28-30)21-13-27-24(26)23-20(21)10-22(32-23)19-5-3-2-4-16(19)11-25/h2-5,10,12-14,18H,6-9H2,1H3,(H2,26,27)
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| InChIKey |
XCKISTZRDFIEIS-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