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Compound database

Compounds similar to this structure

CCC1=CN=CN=C1N2CCN(CC2)CC3=NC4=C(N3)C=C(C=C4)C(F)(F)FEdit in Covalent

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

Aryl halide10,422 Ether8,560 Carboxylic acid7,741 Primary amine6,270 Alcohol6,054 Ester5,501 Alkene4,921 Alkyl halide4,921 Phenol4,082 Ketone3,601 Tertiary amine3,166 Secondary amine2,866

Show all 52

Amide2,582 Nitro2,369 Nitrile1,780 Carbamate1,624 Acetal1,473 Aldehyde1,431 Sulfide1,227 Lactam1,110 Sulfonic acid830 Boronic acid660 Sulfonamide558 Thiol555 Lactone523 Alkyne438 Phosphate435 Acyl halide423 Quaternary ammonium361 Guanidine331 Sulfone322 Epoxide299 Boronic ester273 Silyl ether266 Oxime249 Imine236 Phosphine234 Vinyl halide230 Azo227 Hydrazone215 Isothiocyanate189 Amidine187 Acid anhydride184 Phosphonate175 Isocyanate165 Disulfide159 Sulfonate ester141 Carbonate136 Urea132 Sulfoxide63 Peroxide62 Azide50

Pf-47086711255517-76-0100 % similar 3-[6-(Trifluoromethyl)-1H-benzimidazol-2-yl]propan-1-ol175135-15-641 % similar

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