General Information of the Compound
| Compound ID |
CP0520448
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| Compound Name |
(S)-2-(4-chlorophenyl)-N-(5-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)thiazol-2-yl)-3,3-dimethylbutanamide
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| Structure |
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| Formula |
C18H17ClF6N2O2S
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| Molecular Weight |
474.854
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| Canonical SMILES |
CC(C)(C)[C@H](C(=O)Nc1ncc(s1)C(O)(C(F)(F)F)C(F)(F)F)c1ccc(Cl)cc1
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| InChI |
InChI=1S/C18H17ClF6N2O2S/c1-15(2,3)12(9-4-6-10(19)7-5-9)13(28)27-14-26-8-11(30-14)16(29,17(20,21)22)18(23,24)25/h4-8,12,29H,1-3H3,(H,26,27,28)/t12-/m0/s1
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| InChIKey |
GVUGZEAXWZZCPP-LBPRGKRZSA-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