General Information of the Compound
| Compound ID |
CP0422853
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| Compound Name |
N-[2-[4-(4-fluorophenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl]-N-(2-methylpropyl)furan-2-carboxamide
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| Structure |
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| Formula |
C24H25FN2O3S
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| Molecular Weight |
440.54
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| Canonical SMILES |
CC(C)CN(CC(=O)N1CCc2sccc2C1c1ccc(F)cc1)C(=O)c1ccco1
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| InChI |
InChI=1S/C24H25FN2O3S/c1-16(2)14-26(24(29)20-4-3-12-30-20)15-22(28)27-11-9-21-19(10-13-31-21)23(27)17-5-7-18(25)8-6-17/h3-8,10,12-13,16,23H,9,11,14-15H2,1-2H3
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| InChIKey |
SOJIUHKHURKSAN-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