General Information of the Compound
| Compound ID |
CP0513958
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| Compound Name |
(S)-2-(4-chlorophenyl)-3,3-dimethyl-N-(5-(trifluoromethyl)thiazol-2-yl)butanamide
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| Structure |
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| Formula |
C16H16ClF3N2OS
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| Molecular Weight |
376.831
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| Canonical SMILES |
CC(C)(C)[C@H](C(=O)Nc1ncc(s1)C(F)(F)F)c1ccc(Cl)cc1
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| InChI |
InChI=1S/C16H16ClF3N2OS/c1-15(2,3)12(9-4-6-10(17)7-5-9)13(23)22-14-21-8-11(24-14)16(18,19)20/h4-8,12H,1-3H3,(H,21,22,23)/t12-/m0/s1
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| InChIKey |
QONPGEVPURDSTJ-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