General Information of the Compound
| Compound ID |
CP0559565
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| Compound Name |
N-[4-(2-fluoro-5,7-dihydro-4H-thieno[2,3-c]pyridin-6-yl)-2,6-dimethylphenyl]-3,3-dimethylbutanamide
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| Structure |
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| Formula |
C21H27FN2OS
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| Molecular Weight |
374.525
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| Canonical SMILES |
Cc1cc(cc(C)c1NC(=O)CC(C)(C)C)N1CCc2cc(F)sc2C1
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| InChI |
InChI=1S/C21H27FN2OS/c1-13-8-16(24-7-6-15-10-18(22)26-17(15)12-24)9-14(2)20(13)23-19(25)11-21(3,4)5/h8-10H,6-7,11-12H2,1-5H3,(H,23,25)
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| InChIKey |
RCIKALGYTRGPPN-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