General Information of the Compound
| Compound ID |
CP0561206
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| Compound Name |
2-[(2-bromo-2,2-difluoroacetyl)amino]-N-[2-(trifluoromethoxy)phenyl]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide
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| Structure |
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| Formula |
C17H12BrF5N2O3S
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| Molecular Weight |
499.255
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| Canonical SMILES |
FC(F)(F)Oc1ccccc1NC(=O)c1c(NC(=O)C(F)(F)Br)sc2CCCc12
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| InChI |
InChI=1S/C17H12BrF5N2O3S/c18-16(19,20)15(27)25-14-12(8-4-3-7-11(8)29-14)13(26)24-9-5-1-2-6-10(9)28-17(21,22)23/h1-2,5-6H,3-4,7H2,(H,24,26)(H,25,27)
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| InChIKey |
PHFGVFMIKPIXDX-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