bla

Reference Set (40 Compounds)

CC1(C)[C@H](C(=O)O)N2C(=O)C[C@H]2S1(=O)=O ZINC000000897244

ZINC000000897244 (search)

C[C@]1(Cn2ccnn2)[C@H](C(=O)O)N2C(=O)C[C@H]2S1(=O)=O ZINC000003787060

ZINC000003787060 (search)

$O=C(O)C1=CS[C@@H]2/C(=C\c3cn4c5c(sc4n3)CCC5)C(=O)N12 ZINC000013580839$

ZINC000013580839 (search)

C/C=C1/C(=O)N2C(C(=O)O)=C3[C@@H](OC)CCC[C@@H]3[C@H]12 ZINC000028710914

ZINC000028710914 (search)

C/C=C1/C(=O)N2C(C(=O)O)=C3[C@H](OCC)CCC[C@H]3[C@H]12 ZINC000028710915

ZINC000028710915 (search)

C/C=C1/C(=O)N2C(C(=O)O)=C3[C@@H](OCC)CCC[C@@H]3[C@H]12 ZINC000028710916

ZINC000028710916 (search)

C/C=C1/C(=O)N2C(C(=O)O)=C3[C@@H](OC(C)C)CCC[C@@H]3[C@H]12 ZINC000028710917

ZINC000028710917 (search)

C/C=C1/C(=O)N2C(C(=O)O)=C3[C@H](OCCCC)CCC[C@H]3[C@H]12 ZINC000028710918

ZINC000028710918 (search)

C/C=C1/C(=O)N2C(C(=O)O)=C3[C@@H](OCCCC)CCC[C@@H]3[C@H]12 ZINC000028710919

ZINC000028710919 (search)

C/C=C1/C(=O)N2C(C(=O)O)=C3[C@@H](OCCF)CCC[C@@H]3[C@H]12 ZINC000028710920

ZINC000028710920 (search)

C/C=C1/C(=O)N2C(C(=O)O)=C3[C@@H](OCCC#N)CCC[C@@H]3[C@H]12 ZINC000028710921

ZINC000028710921 (search)

$C[C@@H]1C/C(=C2\O[C@@H]3CC(=O)N3[C@H]2C(=O)O)C(=O)O1 ZINC000068250404$

ZINC000068250404 (search)

O=C(O)/C(C/C=C/c1ccccc1)=C1/O[C@@H]2CC(=O)N2[C@@H]1C(=O)OCc1ccccc1 ZINC000116194274

ZINC000116194274 (search)

$C=CC/C(C(=O)O)=C1\O[C@@H]2CC(=O)N2[C@@H]1C(=O)OC ZINC000198437742$

ZINC000198437742 (search)

$C=CC/C(C(=O)O)=C1\O[C@@H]2CC(=O)N2[C@H]1C(=O)OCc1ccccc1 ZINC000198437769$

ZINC000198437769 (search)

COC(=O)[C@@H]1/C(=C(/C/C=C/c2ccccc2)C(=O)O)O[C@@H]2CC(=O)N12 ZINC000204053626

ZINC000204053626 (search)

$O=C(OCc1ccccc1)[C@@H]1/C(=C(\CO)C/C=C/c2ccccc2)O[C@@H]2CC(=O)N12 ZINC000204053685$

ZINC000204053685 (search)

$O=C(OCc1ccccc1)[C@@H]1/C(=C2\CO[C@@H](CI)C2)O[C@@H]2CC(=O)N12 ZINC000205375661$

ZINC000205375661 (search)

$CCC/C(C(=O)O)=C1\O[C@@H]2CC(=O)N2[C@H]1C(=O)O ZINC000205376081$

ZINC000205376081 (search)

CC(C)(C)C(=O)OCOC(=O)[C@@H]1/C(=C(/C/C=C/c2ccccc2)C(=O)O)O[C@@H]2CC(=O)N12 ZINC000205376290

ZINC000205376290 (search)

COC(=O)[C@@H]1/C(=C(/CCCc2ccccc2)C(=O)O)O[C@@H]2CC(=O)N12 ZINC000205376513

ZINC000205376513 (search)

COC(=O)[C@]1(C/C=C/c2ccccc2)/C(=C/C(=O)O)O[C@@H]2CC(=O)N21 ZINC000205376924

ZINC000205376924 (search)

$C[C@@H]1C/C(=C2\O[C@@H]3CC(=O)N3[C@H]2C(=O)OCc2ccccc2)C(=O)O1 ZINC000205376996$

ZINC000205376996 (search)

$CCC/C(C(=O)O)=C1\O[C@@H]2CC(=O)N2[C@H]1C(=O)OC ZINC000205377065$

ZINC000205377065 (search)

COC(=O)[C@@H]1/C(=C2/C[C@H](CI)OC2=O)O[C@@H]2CC(=O)N12 ZINC000205377104

ZINC000205377104 (search)

$C=CC/C(CO)=C1\O[C@@H]2CC(=O)N2[C@H]1C(=O)OCc1ccccc1 ZINC000205377400$

ZINC000205377400 (search)

O=C(O)/C(C/C=C/CN(Cc1ccccc1)C(=O)OCc1ccccc1)=C1/O[C@@H]2CC(=O)N2[C@H]1C(=O)OCc1ccccc1 ZINC000205377717

ZINC000205377717 (search)

COC(=O)/C(CCCc1ccccc1)=C1/O[C@@H]2CC(=O)N2[C@@H]1C(=O)OC ZINC000205379923

ZINC000205379923 (search)

$O=C(O)/C=C1\O[C@@H]2CC(=O)N2[C@]1(C/C=C/c1ccccc1)C(=O)OCc1ccccc1 ZINC000205380702$

ZINC000205380702 (search)

$C=CC/C(C=O)=C1\O[C@@H]2CC(=O)N2[C@@H]1C(=O)OC ZINC000222277411$

ZINC000222277411 (search)

CC(C)(C)C(=O)OCOC(=O)[C@]1(C/C=C/c2ccccc2)/C(=C/C=O)O[C@@H]2CC(=O)N21 ZINC000222281631

ZINC000222281631 (search)

COC(=O)[C@]1(C/C=C/c2ccccc2)/C(=C/C=O)O[C@@H]2CC(=O)N21 ZINC000222281954

ZINC000222281954 (search)

O=C/C(C/C=C/CO)=C1/O[C@@H]2CC(=O)N2[C@@H]1C(=O)OCc1ccccc1 ZINC000222282031

ZINC000222282031 (search)

$CC(C)(C)C(=O)OCOC(=O)[C@@H]1/C(=C(\C=O)C/C=C/c2ccccc2)O[C@@H]2CC(=O)N12 ZINC000222283647$

ZINC000222283647 (search)

$O=C/C=C1\O[C@@H]2CC(=O)N2[C@]1(C/C=C/CO)C(=O)OCc1ccccc1 ZINC000222286620$

ZINC000222286620 (search)

$O=C/C=C1\O[C@@H]2CC(=O)N2[C@]1(C/C=C/c1ccccc1)C(=O)OCc1ccccc1 ZINC000222287386$

ZINC000222287386 (search)

$COC(=O)[C@@H]1/C(=C(\C=O)C/C=C/c2ccccc2)O[C@@H]2CC(=O)N12 ZINC000222773320$

ZINC000222773320 (search)

O=C1O[C@@H](CI)C/C1=C1/O[C@@H]2CC(=O)N2[C@@H]1C(=O)OCc1ccccc1 ZINC001772621425

ZINC001772621425 (search)

$[N-]=[N+]=NC[C@H]1C/C(=C2\O[C@@H]3CC(=O)N3[C@H]2C(=O)OCc2ccccc2)C(=O)O1 ZINC001772622651$

ZINC001772622651 (search)

C[C@H]1C/C(=C2/O[C@@H]3CC(=O)N3[C@H]2C(=O)O)C(=O)O1 ZINC001772654959

ZINC001772654959 (search)