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Compound database

Compounds similar to this structure

c1ccc2c(Oc3nc(Nc4ccc(N5CCOCC5)cc4)c4ncn(C5CCCCC5)c4n3)cccc2c1Edit in Covalent

4 compounds score at least 30 % on Tanimoto similarity of circular fingerprints, most similar first.

Aryl halide10,422 Ether8,559 Carboxylic acid7,739 Primary amine6,350 Alcohol6,053 Ester5,501 Alkyl halide4,921 Alkene4,917 Phenol3,992 Ketone3,601 Tertiary amine3,165 Amide2,894

Show all 52

Secondary amine2,877 Nitro2,369 Nitrile1,781 Carbamate1,769 Acetal1,473 Aldehyde1,431 Sulfide1,227 Lactam1,160 Sulfonic acid829 Boronic acid660 Sulfonamide564 Lactone523 Thiol514 Alkyne438 Phosphate435 Acyl halide423 Quaternary ammonium361 Guanidine334 Sulfone322 Epoxide299 Boronic ester273 Silyl ether266 Oxime247 Phosphine234 Imine230 Vinyl halide230 Azo229 Hydrazone197 Isothiocyanate189 Amidine187 Acid anhydride184 Urea178 Phosphonate175 Isocyanate165 Disulfide159 Sulfonate ester141 Carbonate136 Sulfoxide63 Peroxide62 Azide52

Purmorphamine483367-10-8100 % similar Reversine656820-32-537 % similar Cyc-116693228-63-630 % similar Tgx-221663619-89-430 % similar

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