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Compound database
Compounds similar to this structure
N
N
N
H
N
N
N
H
Cc1cc(/C=C/C#N)cc(C)c1N=c1ccnc(Nc2ccc(C#N)cc2)[nH]1
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3 compounds score at least 30 % on Tanimoto similarity of circular fingerprints, most similar first.
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Acetal
1,271
Acid anhydride
156
Acyl halide
365
Alcohol
5,173
Aldehyde
1,044
Alkene
4,384
Alkyl halide
3,785
Alkyne
353
Amide
1,852
Amidine
152
Aryl halide
7,578
Azide
40
Azo
217
Boronic acid
387
Boronic ester
154
Carbamate
1,010
Carbonate
122
Carboxylic acid
6,218
Disulfide
140
Epoxide
265
Ester
4,506
Ether
7,080
Guanidine
254
Hydrazone
203
Imine
204
Isocyanate
126
Isothiocyanate
150
Ketone
3,068
Lactam
855
Lactone
463
Nitrile
1,394
Nitro
1,908
Oxime
211
Peroxide
60
Phenol
3,588
Phosphate
396
Phosphine
175
Phosphonate
144
Primary amine
4,842
Quaternary ammonium
331
Secondary amine
2,332
Silyl ether
241
Sulfide
1,046
Sulfonamide
487
Sulfonate ester
118
Sulfone
264
Sulfonic acid
748
Sulfoxide
57
Tertiary amine
2,740
Thiol
523
Urea
95
Vinyl halide
203
N
N
N
H
N
N
N
H
Rilpivirine
500287-72-9
100 % similar
N
N
H
N
Cl
N
4-[(4-Chloro-2-pyrimidinyl)amino]benzonitrile
244768-32-9
34 % similar
N
N
H
N
H
O
N
4-[(4-Hydroxy-2-pyrimidinyl)amino]benzonitrile
189956-45-4
32 % similar