General Information of the Compound
| Compound ID |
CP0430745
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| Compound Name |
2-(4-(4-chlorophenyl)-2-(4-(trifluoromethyl)phenylamino)thiazol-5-yl)acetic acid
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| Structure |
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| Formula |
C18H12ClF3N2O2S
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| Molecular Weight |
412.82
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| Canonical SMILES |
OC(=O)Cc1sc(Nc2ccc(cc2)C(F)(F)F)nc1-c1ccc(Cl)cc1
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| InChI |
InChI=1S/C18H12ClF3N2O2S/c19-12-5-1-10(2-6-12)16-14(9-15(25)26)27-17(24-16)23-13-7-3-11(4-8-13)18(20,21)22/h1-8H,9H2,(H,23,24)(H,25,26)
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| InChIKey |
MWFNGBNNKZYXKV-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