General Information of the Compound
| Compound ID |
CP0561203
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| Compound Name |
N-(4-methylphenyl)-2-[(2,2,2-trifluoroacetyl)amino]-5,7-dihydro-4H-thieno[2,3-c]pyran-3-carboxamide
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| Structure |
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| Formula |
C17H15F3N2O3S
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| Molecular Weight |
384.379
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| Canonical SMILES |
Cc1ccc(NC(=O)c2c(NC(=O)C(F)(F)F)sc3COCCc23)cc1
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| InChI |
InChI=1S/C17H15F3N2O3S/c1-9-2-4-10(5-3-9)21-14(23)13-11-6-7-25-8-12(11)26-15(13)22-16(24)17(18,19)20/h2-5H,6-8H2,1H3,(H,21,23)(H,22,24)
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| InChIKey |
PWNBHJFRGNSIOD-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