Sentence examples for data of compounds from inspiring English sources

Data of compounds 1 8 have been discussed on the basis of a model describing the evolution of the βc response for D3h and C2v symmetry groups.

Single-crystal synchrotron X-ray diffraction data of Compounds 2 and 3 were collected at 100 K on a D8 goniostat equipped with a Bruker PHOTON100 CMOS detector at Beamline 11.3.1 at the Advanced Light Source ALSS) in Lawrence Berkeley National Laboratory, using synchrotron radiation tuned to λ = 0.7749 Å.

ChEMBL contains the chemical structures and bioactivity data of compounds with drug-like properties.

The crystallographic data of compounds 8 and 10 are given in Table 2.

Table 1 Structures, preparative yields (from 3), and DU-145 proliferation inhibition data of compounds 2a-s.

The accumulation of DMPK data of compounds in pharmaceutical companies has led to the development of in silico models to predict DMPK profiles of newly identified compounds.

The X-ray crystallographic data of compound 12 bound to the active site of squalene synthase provided an important insight into the binding mode of this alternative template that formed 11-membered ring conformations with an intramolecular hydrogen bond.

Crystal data of compound 4 was given in Table 2.

b % ID/mL data of compound 17 (all ROIs, all time points).

Spectroscopic data of compound 8 is being reported for the first time.

(PDF 2 MB) 13065_2012_549_MOESM4_ESM.cif Additional file 4: Spectroscopic data of compound 6.