General Information of the Compound
| Compound ID |
CP0385955
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| Compound Name |
[4-(3,5-dichlorophenyl)-3,5-dihydroxyphenyl]-[4-(trifluoromethyl)phenyl]methanone
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| Structure |
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| Formula |
C20H11Cl2F3O3
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| Molecular Weight |
427.205
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| Canonical SMILES |
Oc1cc(cc(O)c1-c1cc(Cl)cc(Cl)c1)C(=O)c1ccc(cc1)C(F)(F)F
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| InChI |
InChI=1S/C20H11Cl2F3O3/c21-14-5-11(6-15(22)9-14)18-16(26)7-12(8-17(18)27)19(28)10-1-3-13(4-2-10)20(23,24)25/h1-9,26-27H
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| InChIKey |
KYDVOTVCYRYBDK-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
Protein ID: PT01298, Cannabinoid receptor 1
Protein ID: PT00834, Cannabinoid receptor 2