General Information of the Compound
| Compound ID |
CP0487498
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| Compound Name |
[4-(2,5-dichlorophenyl)-3,5-dihydroxyphenyl]-thiophen-2-ylmethanone
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| Formula |
C17H10Cl2O3S
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| Molecular Weight |
365.237
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| Canonical SMILES |
Oc1cc(cc(O)c1-c1cc(Cl)ccc1Cl)C(=O)c1cccs1
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| InChI |
InChI=1S/C17H10Cl2O3S/c18-10-3-4-12(19)11(8-10)16-13(20)6-9(7-14(16)21)17(22)15-2-1-5-23-15/h1-8,20-21H
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| InChIKey |
WCVWIQCOIVCBIX-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