General Information of the Compound
| Compound ID |
CP0424594
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| Compound Name |
[3,5-dihydroxy-4-[3-(trifluoromethyl)phenyl]phenyl]-thiophen-2-ylmethanone
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| Formula |
C18H11F3O3S
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| Molecular Weight |
364.344
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| Canonical SMILES |
Oc1cc(cc(O)c1-c1cccc(c1)C(F)(F)F)C(=O)c1cccs1
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| InChI |
InChI=1S/C18H11F3O3S/c19-18(20,21)12-4-1-3-10(7-12)16-13(22)8-11(9-14(16)23)17(24)15-5-2-6-25-15/h1-9,22-23H
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| InChIKey |
FOEJCOAANWJVQN-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