| Molid | Formula | Iupac | Common Name | Chembl Id | Clinical Phase | Atoms | Charge | Curation | Visibility | Save |
| 1917996 | C16H17F2N5O3S3 | - | - | 429682 | | 46 | 0 | ATB | Public | |
| 1917995 | C13H18N4O6P2S | - | - | 430409 | | 44 | -2 | ATB | Public | |
| 1917994 | C13H21N4O6P2S | - | - | 430409 | | 47 | 1 | ATB | Public | |
| 1917993 | C16H22ClN3O2S2 | - | - | 257230 | | 46 | 0 | ATB | Public | |
| 1917992 | C21H16N5O2S | - | - | 256382 | | 45 | -1 | ATB | Public | |
| 1917991 | C21H17N5O2S | - | - | 256382 | | 46 | 0 | ATB | Public | |
| 1917988 | C19H22N4O | - | - | 272501 | | 46 | 0 | ATB | Public | |
| 1917987 | C17H27N2O | - | - | 256397 | | 47 | 1 | ATB | Public | |
| 1917986 | C17H26N2O | (1R,2S)-2-(aminomethyl)-1-phenyl-N,N-di(propan-2-yl)cyclopropane-1-carboxamide ... | - | 256397 | | 46 | 0 | ATB | Public | |
| 1917985 | C17H19FN2O6S | - | - | 256187 | | 46 | 0 | ATB | Public | |
| 1917984 | C17H19ClN2O6S | - | - | 256018 | | 46 | 0 | ATB | Public | |
| 1917981 | C17H20N2O6S | - | - | 429927 | | 46 | 0 | ATB | Public | |
| 1917980 | C19H21BrN4O | - | - | 401697 | | 46 | 0 | ATB | Public | |
| 1917979 | C20H20N4O2 | N-(2-aminophenyl)-4-[[(6-methoxypyridin-3-yl)amino]methyl]benzamide ... | - | 403596 | | 46 | 0 | ATB | Public | |
| 1917978 | C20H20N4O2 | N-(2-aminophenyl)-4-[[(6-methoxypyridin-2-yl)amino]methyl]benzamide ... | - | 271641 | | 46 | 0 | ATB | Public | |
| 1917977 | C19H25N2O | - | - | 256663 | | 47 | 1 | ATB | Public | |
| 1917976 | C19H24N2O | - | - | 256663 | | 46 | 0 | ATB | Public | |
| 1917975 | C19H23ClFN2O | - | - | 272073 | | 47 | 1 | ATB | Public | |
| 1917974 | C19H22ClFN2O | - | - | 272073 | | 46 | 0 | ATB | Public | |
| 1917973 | C19H18N8O | - | - | 404518 | | 46 | 0 | ATB | Public | |
| 1917972 | C21H20O5 | (2E,5E)-2,5-bis[(4-hydroxy-3-methoxyphenyl)methylidene]cyclopentan-1-one 2,5-bis[(4-hydroxy-3-methoxyphenyl)methylidene]cyclopentan-1-one (2E)-2,5-bis[(4-hydroxy-3-methoxyphenyl)methylidene]cyclopentan-1-one ... | - | 270361 | | 46 | 0 | ATB | Public | |
| 1917971 | C19H23ClFN2O | - | - | 255163 | | 47 | 1 | ATB | Public | |
| 1917970 | C19H22ClFN2O | - | - | 255163 | | 46 | 0 | ATB | Public | |
| 1917969 | C17H20N2O5S2 | - | - | 408906 | | 46 | 0 | ATB | Public | |
| 1917968 | C17H27N2O | - | - | 256039 | | 47 | 1 | ATB | Public | |
| 1917966 | C17H26N2O | - | - | 256039 | | 46 | 0 | ATB | Public | |
| 1917965 | C22H21NO2 | - | - | 273000 | | 46 | 0 | ATB | Public | |
| 1917964 | C17H27N2O | - | - | 272744 | | 47 | 1 | ATB | Public | |
| 1917963 | C17H26N2O | - | - | 272744 | | 46 | 0 | ATB | Public | |
| 1917962 | C12H9N3O4 | - | - | | | 28 | 0 | ATB | Public | |
| 1917961 | C12H9N3O4 | - | - | | | 28 | 0 | ATB | Public | |
| 1917960 | C12H9N3O4 | - | - | | | 28 | 0 | ATB | Public | |
| 1917959 | C12H9N3O4 | - | - | | | 28 | 0 | ATB | Public | |
| 1917957 | C17H27N2O | - | - | 272530 | | 47 | 1 | ATB | Public | |
| 1917956 | C17H26N2O | - | - | 272530 | | 46 | 0 | ATB | Public | |
| 1917955 | C19H18Cl2N2O5 | - | - | 403832 | | 46 | 0 | ATB | Public | |
| 1917954 | C23H16N4O2S | - | - | 255219 | | 46 | 0 | ATB | Public | |
| 1917953 | C21H17F3N3O | - | - | 404165 | | 45 | -1 | ATB | Public | |
| 1917952 | C21H18F3N3O | (2R)-8-[[6-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl]amino]-1,2,3,4-tetrahydronaphthalen-2-ol ... | - | 404165 | | 46 | 0 | ATB | Public | |
| 1917951 | C23H16N4O2S | - | - | 404546 | | 46 | 0 | ATB | Public | |
| 1917950 | C21H16BrF3N3O | - | - | 402637 | | 45 | -1 | ATB | Public | |
| 1917949 | C21H17BrF3N3O | - | - | 402637 | | 46 | 0 | ATB | Public | |
| 1917948 | C21H16ClF3N3O | - | - | 258265 | | 45 | -1 | ATB | Public | |
| 1917947 | C21H17ClF3N3O | - | - | 258265 | | 46 | 0 | ATB | Public | |
| 1917946 | C21H16ClF3N3O | - | - | 258056 | | 45 | -1 | ATB | Public | |
| 1917945 | C21H17ClF3N3O | (2S)-5-chloro-8-[[6-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl]amino]-1,2,3,4-tetrahydronaphthalen-2-ol ... | - | 258056 | | 46 | 0 | ATB | Public | |
| 1917944 | C21H16F4N3O | - | - | 258054 | | 45 | -1 | ATB | Public | |
| 1917943 | C21H17F4N3O | - | - | 258054 | | 46 | 0 | ATB | Public | |
| 1917942 | C21H17N3O3 | - | - | 257426 | | 44 | -2 | ATB | Public | |
| 1917941 | C21H19N3O3 | - | - | 257426 | | 46 | 0 | ATB | Public | |
| 1917940 | C15H19N4O6S | - | - | 272760 | | 45 | -1 | ATB | Public | |
| 1917939 | C15H20N4O6S | - | - | 272760 | | 46 | 0 | ATB | Public | |
| 1917938 | C20H20Cl2N2O2 | - | - | 403848 | | 46 | 0 | ATB | Public | |
| 1917937 | C20H23N4 | - | - | 255802 | | 47 | 1 | ATB | Public | |
| 1917936 | C20H22N4 | 4-(2-cyclopentyl-6,7,8,9-tetrahydro-5H-pyrimido[5,6-d]azepin-4-yl)benzonitrile ... | - | 255802 | | 46 | 0 | ATB | Public | |
| 1917935 | C19H21N2O3 | 4-[1-(benzoyl)piperidin-4-yl]-1-(1,3-oxazol-2-yl)butan-1-one ... | - | 257945 | | 45 | -1 | ATB | Public | |
| 1917934 | C19H22N2O3 | 4-[1-(benzoyl)piperidin-4-yl]-1-(1,3-oxazol-2-yl)butan-1-one ... | - | 257945 | | 46 | 0 | ATB | Public | |
| 1917933 | C20H20ClN5 | - | - | 270849 | | 46 | 0 | ATB | Public | |
| 1917932 | C20H20ClN5 | - | - | 270849 | | 46 | 0 | ATB | Public | |
| 1917931 | C15H30N4O | - | - | 403726 | | 50 | 4 | ATB | Public | |
| 1917930 | C15H26N4O | - | - | 403726 | | 46 | 0 | ATB | Public | |
| 1917929 | C22H16ClN4O2 | - | - | 255635 | | 45 | -1 | ATB | Public | |
| 1917928 | C22H17ClN4O2 | - | - | 255635 | | 46 | 0 | ATB | Public | |
| 1917927 | C22H19ClN2O2 | - | - | 402429 | | 46 | 0 | ATB | Public | |
| 1917926 | C23H17ClN2O3 | - | - | 412058 | | 46 | 0 | ATB | Public | |
| 1917925 | C23H17ClN2O3 | - | - | 269796 | | 46 | 0 | ATB | Public | |
| 1917924 | C19H21NO3S2 | - | - | 429680 | | 46 | 0 | ATB | Public | |
| 1917923 | C15H23N2O4S | - | - | 257893 | | 45 | -1 | ATB | Public | |
| 1917922 | C15H24N2O4S | - | - | 257893 | | 46 | 0 | ATB | Public | |
| 1917921 | C16H23N2O4 | propan-2-yl 4-[4-(1,3-oxazol-2-yl)-4-oxobutyl]piperidine-1-carboxylate ... | - | 255544 | | 45 | -1 | ATB | Public | |
| 1917920 | C16H24N2O4 | propan-2-yl 4-[4-(1,3-oxazol-2-yl)-4-oxobutyl]piperidine-1-carboxylate ... | - | 255544 | | 46 | 0 | ATB | Public | |
| 1917919 | C17H23N3O2S | - | - | 258288 | | 46 | 0 | ATB | Public | |
| 1917918 | C17H23N3O2S | [(2S,3aS,7aS)-2,3,3a,4,5,6,7,7a-octahydro-1H-indol-2-yl]-[(2S)-2-(1,3-thiazole-2-carbonyl)pyrrolidin-1-yl]methanone ... | - | 258288 | | 46 | 0 | ATB | Public | |
| 1917917 | C8H13O2S2 | 5-[(3R)-dithiolan-3-yl]pentanoate ... | - | 134342 | | 25 | -1 | ATB | Public | |
| 1917916 | C16H33O4S | hexadecyl hydrogen sulfate ... | - | | | 54 | -1 | ATB | Public | |
| 1917915 | C21H20N3O3 | - | - | 404077 | | 47 | 1 | ATB | Public | |
| 1917914 | C21H19N3O3 | - | - | 404077 | | 46 | 0 | ATB | Public | |
| 1917913 | C22H19N4O2 | - | - | 430412 | | 47 | 1 | ATB | Public | |
| 1917912 | C22H18N4O2 | - | - | 430412 | | 46 | 0 | ATB | Public | |
| 1917911 | C21H38N | - | - | 1907001 | 0 | 60 | 1 | ATB | Public | |
| 1917910 | C21H19NO5 | - | - | 272071 | | 46 | 0 | ATB | Public | |
| 1917909 | C22H18ClN4O2 | - | - | 255607 | | 47 | 1 | ATB | Public | |
| 1917908 | C22H17ClN4O2 | - | - | 255607 | | 46 | 0 | ATB | Public | |
| 1917907 | C21H21N4O | - | - | 402890 | | 47 | 1 | ATB | Public | |
| 1917906 | C21H20N4O | - | - | 402890 | | 46 | 0 | ATB | Public | |
| 1917905 | C23H16Cl3NO3 | - | - | 402889 | | 46 | 0 | ATB | Public | |
| 1917904 | C22H18FN4O2 | - | - | 403337 | | 47 | 1 | ATB | Public | |
| 1917903 | C22H17FN4O2 | - | - | 403337 | | 46 | 0 | ATB | Public | |
| 1917902 | C22H17ClN4O2 | - | - | 429251 | | 46 | 0 | ATB | Public | |
| 1917901 | C22H15ClF2N4O2 | - | - | 401779 | | 46 | 0 | ATB | Public | |
| 1917900 | C22H15Cl3N4O2 | - | - | 270183 | | 46 | 0 | ATB | Public | |
| 1917899 | C22H16BrClN4O2 | - | - | 437973 | | 46 | 0 | ATB | Public | |
| 1917898 | C22H18N4O2 | - | - | 404497 | | 46 | 0 | ATB | Public | |
| 1917897 | C21H16N5O3 | - | - | 258365 | | 45 | -1 | ATB | Public | |
| 1917896 | C21H17N5O3 | - | - | 258365 | | 46 | 0 | ATB | Public | |
| 1917895 | C18H25N4 | - | - | 273173 | | 47 | 1 | ATB | Public | |
| 1917894 | C18H24N4 | - | - | 273173 | | 46 | 0 | ATB | Public | |
| 1917893 | C20H20BrN3OS | - | - | 403912 | | 46 | 0 | ATB | Public | |
| 1917892 | C19H18N4O4S | - | - | 256257 | | 46 | 0 | ATB | Public | |
| 1917891 | C20H19Cl2N3OS | - | - | 271900 | | 46 | 0 | ATB | Public | |