General Information of the Compound
| Compound ID |
CP0419010
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| Compound Name |
4-(4-acetamidophenyl)-N-(phenylmethyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide
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| Structure |
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| Formula |
C23H21N3O3
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| Molecular Weight |
387.439
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| Canonical SMILES |
CC(=O)Nc1ccc(cc1)-c1ccnc2OC(Cc12)C(=O)NCc1ccccc1
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| InChI |
InChI=1S/C23H21N3O3/c1-15(27)26-18-9-7-17(8-10-18)19-11-12-24-23-20(19)13-21(29-23)22(28)25-14-16-5-3-2-4-6-16/h2-12,21H,13-14H2,1H3,(H,25,28)(H,26,27)
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| InChIKey |
YUPMKLMHZPJCGW-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
Protein ID: PT02997, Isocitrate dehydrogenase [NADP] cytoplasmic
Protein ID: PT06124, Paired box protein Pax-8