General Information of the Compound
| Compound ID |
CP0017326
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| Compound Name |
1-[4-[4-[7-amino-2-(4-methylsulfonylphenyl)furo[2,3-c]pyridin-4-yl]pyrazol-1-yl]piperidin-1-yl]ethanone
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| Structure |
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| Formula |
C24H25N5O4S
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| Molecular Weight |
479.562
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| Canonical SMILES |
CC(=O)N1CCC(CC1)n1cc(cn1)-c1cnc(N)c2oc(cc12)-c1ccc(cc1)S(C)(=O)=O
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| InChI |
InChI=1S/C24H25N5O4S/c1-15(30)28-9-7-18(8-10-28)29-14-17(12-27-29)21-13-26-24(25)23-20(21)11-22(33-23)16-3-5-19(6-4-16)34(2,31)32/h3-6,11-14,18H,7-10H2,1-2H3,(H2,25,26)
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| InChIKey |
GZQOVUWRKQMKGN-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