| Molid | Formula | Iupac | Common Name | Chembl Id | Clinical Phase | Atoms | Charge | Curation | Visibility | Save |
| 1970940 | C37H74N6O5S2 | - | - | | | 124 | 0 | ATB | Public | |
| 1970931 | C37H74N6O5S2 | - | - | | | 124 | 0 | ATB | Public | |
| 1970916 | C17H25N3O | - | - | 3651575 | | 46 | 0 | ATB | Public | |
| 1970915 | C17H27N3O | - | - | 3651574 | | 48 | 2 | ATB | Public | |
| 1970914 | C17H25N3O | - | - | 3651574 | | 46 | 0 | ATB | Public | |
| 1970912 | C5H8 | 2-methylbuta-1,3-diene ... | Isoprene | 1566132 | | 13 | 0 | ATB | Public | |
| 1970911 | C17H27N3O | - | - | 3651571 | | 48 | 2 | ATB | Public | |
| 1970910 | C17H25N3O | - | - | 3651571 | | 46 | 0 | ATB | Public | |
| 1970898 | C19H17F3N4O2S | - | - | 3651493 | | 46 | 0 | ATB | Public | |
| 1970897 | C18H15ClF3N5O3S | - | - | 3651470 | | 46 | 0 | ATB | Public | |
| 1970895 | C18H15ClF3N5O3S | - | - | 3651465 | | 46 | 0 | ATB | Public | |
| 1970894 | C20H13N7O3S | - | - | 3651463 | | 44 | -2 | ATB | Public | |
| 1970892 | C19H19ClN2O4S | - | - | 3651439 | | 46 | 0 | ATB | Public | |
| 1970891 | C22H18N5 | - | - | 3651375 | | 45 | -1 | ATB | Public | |
| 1970885 | C21H19N5O | - | - | 3651308 | | 46 | 0 | ATB | Public | |
| 1970884 | C21H19N5O | - | - | 3651308 | | 46 | 0 | ATB | Public | |
| 1970883 | C21H17F3N5O | - | - | 3651085 | | 47 | 1 | ATB | Public | |
| 1970882 | C21H16F3N5O | - | - | 3651085 | | 46 | 0 | ATB | Public | |
| 1970881 | C19H19N5O3 | - | - | 3651038 | | 46 | 0 | ATB | Public | |
| 1970879 | C20H17N4O4 | - | - | 3651022 | | 45 | -1 | ATB | Public | |
| 1970877 | C21H17N4O3 | - | - | 3651002 | | 45 | -1 | ATB | Public | |
| 1970876 | C21H18N4O3 | - | - | 3651002 | | 46 | 0 | ATB | Public | |
| 1970875 | C20H19ClN4O2 | - | - | 3650906 | | 46 | 0 | ATB | Public | |
| 1970874 | C20H18Cl2N4O2 | - | - | 3650893 | | 46 | 0 | ATB | Public | |
| 1970873 | C20H18Cl2N4O2 | - | - | 3650890 | | 46 | 0 | ATB | Public | |
| 1970871 | C20H19ClN4O2 | - | - | 3650880 | | 46 | 0 | ATB | Public | |
| 1970870 | C19H18ClN4O3 | - | - | 3650782 | | 45 | -1 | ATB | Public | |
| 1970869 | C19H19ClN4O3 | - | - | 3650782 | | 46 | 0 | ATB | Public | |
| 1970868 | C19H18N7O | - | - | 3650749 | | 45 | -1 | ATB | Public | |
| 1970867 | C19H19N7O | - | - | 3650749 | | 46 | 0 | ATB | Public | |
| 1970866 | C19H18N7O | - | - | 3650733 | | 45 | -1 | ATB | Public | |
| 1970865 | C19H19N7O | - | - | 3650733 | | 46 | 0 | ATB | Public | |
| 1970864 | C20H20NO4 | - | - | 3650444 | | 45 | -1 | ATB | Public | |
| 1970863 | C20H21NO4 | - | - | 3650444 | | 46 | 0 | ATB | Public | |
| 1970862 | C19H17N4O4S | - | - | 3650432 | | 45 | -1 | ATB | Public | |
| 1970861 | C19H18N4O4S | - | - | 3650432 | | 46 | 0 | ATB | Public | |
| 1970860 | C17H23N3O2S | - | - | 3650312 | | 46 | 0 | ATB | Public | |
| 1970859 | C19H15F4N5O2S | - | - | 3650226 | | 46 | 0 | ATB | Public | |
| 1970858 | C18H17F5N4OS | - | - | 3650179 | | 46 | 0 | ATB | Public | |
| 1970857 | C19H19F2N3O2S | - | - | 3650177 | | 46 | 0 | ATB | Public | |
| 1970856 | C20H17F2N4OS | - | - | 3650173 | | 45 | -1 | ATB | Public | |
| 1970855 | C20H18F2N4OS | - | - | 3650173 | | 46 | 0 | ATB | Public | |
| 1970854 | C19H18F2N3O2S | - | - | 3650171 | | 45 | -1 | ATB | Public | |
| 1970853 | C19H19F2N3O2S | - | - | 3650171 | | 46 | 0 | ATB | Public | |
| 1970852 | C19H19F2N3O2S | - | - | 3650170 | | 46 | 0 | ATB | Public | |
| 1970851 | C18H24N3O2 | - | - | 3649780 | | 47 | 1 | ATB | Public | |
| 1970850 | C18H23N3O2 | - | - | 3649780 | | 46 | 0 | ATB | Public | |
| 1970849 | C18H24N3O2 | - | - | 3649773 | | 47 | 1 | ATB | Public | |
| 1970848 | C18H23N3O2 | - | - | 3649773 | | 46 | 0 | ATB | Public | |
| 1970847 | C18H24N3O2 | - | - | 3649718 | | 47 | 1 | ATB | Public | |
| 1970846 | C18H23N3O2 | - | - | 3649718 | | 46 | 0 | ATB | Public | |
| 1970845 | C18H24N3O2 | - | - | 3649717 | | 47 | 1 | ATB | Public | |
| 1970844 | C18H23N3O2 | - | - | 3649717 | | 46 | 0 | ATB | Public | |
| 1970843 | C20H17N5O4 | - | - | 3649635 | | 46 | 0 | ATB | Public | |
| 1970842 | C18H20N6O2 | - | - | 3649520 | | 46 | 0 | ATB | Public | |
| 1970841 | C22H17FN4O2 | - | - | 3649503 | | 46 | 0 | ATB | Public | |
| 1970840 | C21H17FN4O2S | - | - | 3649486 | | 46 | 0 | ATB | Public | |
| 1970839 | C21H16F2N4O2S | - | - | 3649484 | | 46 | 0 | ATB | Public | |
| 1970837 | C19H17ClN6O2S | - | - | 3649445 | | 46 | 0 | ATB | Public | |
| 1970835 | C19H17ClN6O2S | - | - | 3649439 | | 46 | 0 | ATB | Public | |
| 1970833 | C19H17ClN6O2S | - | - | 3649438 | | 46 | 0 | ATB | Public | |
| 1970832 | C19H20F2N4O | - | - | 3649230 | | 46 | 0 | ATB | Public | |
| 1970831 | C19H20F2N4O | - | - | 3649223 | | 46 | 0 | ATB | Public | |
| 1970830 | C21H17BrF2N4O | - | - | 3649203 | | 46 | 0 | ATB | Public | |
| 1970829 | C19H20FIN4O | - | - | 3649188 | | 46 | 0 | ATB | Public | |
| 1970828 | C19H21BrN4O | - | - | 3649045 | | 46 | 0 | ATB | Public | |
| 1970827 | C18H19N6O2 | - | - | 3649011 | | 45 | -1 | ATB | Public | |
| 1970826 | C18H20N6O2 | - | - | 3649011 | | 46 | 0 | ATB | Public | |
| 1970825 | C18H20FN5O2 | - | - | 3649006 | | 46 | 0 | ATB | Public | |
| 1970824 | C18H21N5O2 | - | - | 3649003 | | 46 | 0 | ATB | Public | |
| 1970823 | C19H20ClN5O | - | - | 3648925 | | 46 | 0 | ATB | Public | |
| 1970822 | C19H19FN5O | - | - | 3648921 | | 45 | -1 | ATB | Public | |
| 1970821 | C19H20FN5O | - | - | 3648921 | | 46 | 0 | ATB | Public | |
| 1970820 | C18H19F2N5OS | - | - | 3648447 | | 46 | 0 | ATB | Public | |
| 1970819 | C18H19F2N5OS | - | - | 3648447 | | 46 | 0 | ATB | Public | |
| 1970818 | C20H20N6 | - | - | 3648444 | | 46 | 0 | ATB | Public | |
| 1970817 | C19H15ClN4O6S | - | - | 3648273 | | 46 | 0 | ATB | Public | |
| 1970816 | C19H17N7O3 | - | - | 3648251 | | 46 | 0 | ATB | Public | |
| 1970815 | C20H16F2N5O2 | - | - | 3648228 | | 45 | -1 | ATB | Public | |
| 1970814 | C20H17F2N5O2 | - | - | 3648228 | | 46 | 0 | ATB | Public | |
| 1970813 | C20H18N5O2 | - | - | 3648225 | | 45 | -1 | ATB | Public | |
| 1970812 | C20H19N5O2 | - | - | 3648225 | | 46 | 0 | ATB | Public | |
| 1970811 | C20H16FN5O2 | - | - | 3648223 | | 44 | -2 | ATB | Public | |
| 1970810 | C20H18FN5O2 | - | - | 3648223 | | 46 | 0 | ATB | Public | |
| 1970809 | C16H20BrN4O2S2 | - | - | 3648104 | | 45 | -1 | ATB | Public | |
| 1970808 | C16H21BrN4O2S2 | - | - | 3648104 | | 46 | 0 | ATB | Public | |
| 1970806 | C16H20BrN4O2S2 | - | - | 3648103 | | 45 | -1 | ATB | Public | |
| 1970805 | C16H21BrN4O2S2 | - | - | 3648103 | | 46 | 0 | ATB | Public | |
| 1970804 | C21H18N4O3 | - | - | 3648052 | | 46 | 0 | ATB | Public | |
| 1970803 | C20H19N5O2 | - | - | 3648038 | | 46 | 0 | ATB | Public | |
| 1970802 | C22H18Cl2N4 | N-(3,4-dichlorophenyl)-7-(2,6-dimethylphenyl)-5-methyl-1,2,4-benzotriazin-3-amine ... | - | 3648017 | | 46 | 0 | ATB | Public | |
| 1970801 | C22H18ClFN4 | N-(3-chloro-4-fluorophenyl)-7-(2,6-dimethylphenyl)-5-methyl-1,2,4-benzotriazin-3-amine ... | - | 3648013 | | 46 | 0 | ATB | Public | |
| 1970800 | C20H23N4 | - | - | 3647979 | | 47 | 1 | ATB | Public | |
| 1970795 | C27H47O3 | (3S,5R,8S,9S,10R,13R,14S,17R)-5-hydroperoxy-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,3,4,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-ol ... | - | | | 77 | -1 | ATB | Public | |
| 1970794 | C27H47O3 | (3S,5R,8S,9S,10R,13R,14S,17R)-5-hydroperoxy-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,3,4,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-ol ... | - | | | 77 | -1 | ATB | Public | |
| 1970793 | C170H306O48 | - | - | | | 524 | 0 | Template | Public | |
| 1970792 | C18H20ClN5O2 | - | - | 3647840 | | 46 | 0 | ATB | Public | |
| 1970791 | C18H19ClFN5O2 | - | - | 3647837 | | 46 | 0 | ATB | Public | |
| 1970790 | C22H16N5OS | - | - | 3647628 | | 45 | -1 | ATB | Public | |
| 1970789 | C22H17N5OS | - | - | 3647628 | | 46 | 0 | ATB | Public | |