Analog ID	Similarity score	SMILES	Selection options Mcule | MolPort | All | None
MCULE-4825386658	1	C(=CC1=CC=C(C(O)=C1)O)C(OC)=O
MCULE-5269580490	1	C1(=C(C=CC(=C1)/C=C/C(=O)OC)O)O
MCULE-2639296166	0.96	C1(O)C(O)=CC(C=CC(OCC)=O)=CC=1
MCULE-6271208728	0.96	C1(O)C=C(/C=C/C(=O)OCC)C=CC=1O
MCULE-6094055690	0.94	C(OC)(=O)C=CC1=CC=CC(O)=C1
MCULE-5916017124	0.91	O=C(OCC)/C=C/C1C=CC=C(O)C=1
MCULE-1633691755	0.91	C(OCC)(C=CC1C=CC=C(O)C=1)=O
MCULE-7533572392	0.90	C(=CC1C=CC(=C(O)C=1)OC)C(OC)=O
MCULE-7654618031	0.90	C(=CC1C=CC(=CC=1)O)C(OC)=O
MCULE-2069871168	0.90	C(O)(=O)C=CC1=CC=C(C(O)=C1)O
MCULE-5757199598	0.90	C1(O)C=C(/C=C/C(=O)OC)C=CC=1OC
MCULE-8717776291	0.90	COC(/C=C/C1C=CC(O)=CC=1)=O
MCULE-9406290643	0.90	C1C=C(/C=C/C(=O)OC(/C=C/C2C=C(O)C(O)=CC=2)=O)C=C(O)C=1O
MCULE-7843599914	0.90	C(O)(=O)/C=C/C1=CC=C(C(O)=C1)O
MCULE-1297302420	0.88	C(=CC1C=CC(O)=C(OC)C=1)C(OC)=O
MCULE-7084750759	0.88	C1(=C(C=CC(=C1)/C=C/C(=O)OC)O)OC
MolPort-039-339-068	0.87	COc1cc(C)c2c(oc(CC(C)=O)cc2=O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1OC(=O)\C=C\c1ccc(O)cc1
MolPort-039-339-068	0.87	COc1cc(C)c2c(oc(CC(C)=O)cc2=O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1OC(=O)\C=C\c1ccc(O)cc1
MCULE-8291716022	0.87	C1(O)C=C(/C=C/C(=O)OCC)C=CC=1OC
MCULE-2959640396	0.87	C(=CC1C=CC(=CC=1)O)C(OCC)=O
MCULE-2249067422	0.87	C1C=C(/C=C/C(=O)OCC)C=CC=1O
MCULE-6517390288	0.86	C(=CC(OC)=O)C1C=C(O)C=CC=1O
MCULE-1327640373	0.86	O(C)C(=O)/C=C/C1=C(C=CC(O)=C1)O
MCULE-2994486927	0.85	C(=C/C1C=CC(=C(OC)C=1)OC)\C(OC)=O
MCULE-5006038728	0.85	C(O)(=O)/C=C/C1C=CC=C(O)C=1
MCULE-4743217929	0.85	C1(=C(C=CC(=C1)C=CC(=O)OCC)O)OC
MCULE-8928982037	0.85	C1(OC)C=C(/C=C/C(=O)OCC)C=CC=1O
MCULE-1947701492	0.85	C(=CC1C=CC(=C(OC)C=1)OC)C(OC)=O
MCULE-2569094851	0.85	C(O)(=O)C=CC1C=CC=C(O)C=1
MCULE-6858443755	0.85	C1(O)C=C(/C=C/COC)C=CC=1O
MCULE-3227837163	0.84	O=C(/C=C/C1C=C(OC)C(O)=CC=1)OC(C)C
MCULE-9394957877	0.84	C(=CC1C=CC=C(OC)C=1)C(OC)=O
MolPort-039-339-067	0.83	COc1cc(C)c2c(oc(C[C@@H](C)O)cc2=O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1OC(=O)\C=C\c1ccc(O)cc1
MolPort-039-339-067	0.83	COc1cc(C)c2c(oc(C[C@@H](C)O)cc2=O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1OC(=O)\C=C\c1ccc(O)cc1
MCULE-7925803308	0.83	C(=CC1C=CC(=C(OC)C=1)OC)C(OCC)=O
MCULE-4571364221	0.83	COC1=C(O)C=C(C=CC(O)=O)C=C1
MCULE-2906396849	0.83	O=C(/C=C/C1C=C(OC)C(O)=C(OC)C=1)OC
MCULE-7013523945	0.83	C1=C(OC)C(O)=CC(=C1)/C=C/C(=O)O
MolPort-019-937-281	0.82	CC(=O)Cc1cc(=O)c2c(C)cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3OC(=O)\C=C\c3ccc(O)cc3)c2o1
MolPort-019-937-281	0.82	CC(=O)Cc1cc(=O)c2c(C)cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3OC(=O)\C=C\c3ccc(O)cc3)c2o1
MCULE-6132995974	0.82	CCOC(C=CC1=CC(OC)=CC=C1)=O
MCULE-3790454540	0.82	C(=CC1=CC=C(C=C1)OC)C(OC)=O
MCULE-5938473801	0.81	C(OC(C)C)(=O)C=CC1=CC=C(C(OC)=C1)OC
MCULE-8442047802	0.81	C(O)(=O)/C=C/C1=CC=C(C(OC)=C1)O
MCULE-2647951649	0.81	C(O)(=O)C=CC1=CC=C(O)C(O)=C1O
MCULE-2590309260	0.81	C(O)(=O)C=CC1=CC=C(C=C1)O
MCULE-8675181272	0.81	O=C(/C=C/C1C=C(OC)C(O)=CC=1)OC/C=C/C1C=C(OC)C(O)=CC=1
MCULE-6127598109	0.81	C(O)(=O)C=CC1=CC=C(C(OC)=C1)O
MCULE-3302207880	0.81	C1(O)=CC=C(C=CC(=O)OCC=CC2C=CC(O)=C(OC)C=2)C=C1OC
MCULE-9551292063	0.81	C(O)(=O)/C=C/C1=CC=C(C=C1)O
MCULE-7539638665	0.80	CCOC(C=CC1=CC=C(OC)C=C1)=O
MCULE-9094428143	0.80	[Na+].C([O-])(=O)C=CC1=CC=C(O)C(OC)=C1
MCULE-4113907065	0.80	C(=CC1=CC=CC(OCC)=C1)C(OC)=O
MCULE-3421702175	0.80	C1(OC)=C(OC)C(=CC(/C=C/C(=O)OC)=C1)OC
MCULE-5476569550	0.80	[Na+].COC1C=C(/C=C/C(=O)[O-])C=CC=1O
MCULE-6770320666	0.80	C1(OC)=C(OC)C=C(C=C1OC)C=CC(OC)=O
MCULE-5863166290	0.80	C1(OC)=C(O)C(OC)=CC(/C=C/C(=O)OCC)=C1
MCULE-7411005425	0.80	CCOC(C=CC1=CC(OC)=C(O)C(OC)=C1)=O
MCULE-3659493926	0.80	C1C=C(/C=C/C(=O)OCC)C=CC=1OC
MCULE-8435564843	0.80	CCOC1=C(OC)C=C(C=CC(OC)=O)C=C1
MCULE-8387463530	0.80	OC1=C(O)C=CC=C1C=CC(O)=O
MCULE-5134512966	0.79	C(O)(=O)C=CC1C=CC(=C(OC)C=1)OC
MCULE-3982495166	0.79	COC(C=CC1=CC(OC)=C(OC(C)C)C=C1)=O
MCULE-1562931521	0.79	CCOC1=C(OCC)C=C(C=CC(OC)=O)C=C1
MCULE-4648711215	0.79	C1=C(OC)C(OC)=CC(/C=C/C(=O)O)=C1
MCULE-4305805410	0.79	C(OC)(C=CC1C=C(OC)C=C(OC)C=1)=O
MCULE-6096090529	0.79	COC(C=CC1=CC2=C(C=C(C=C2)OC)C=C1)=O
MCULE-6613332253	0.78	CCOC(C=CC1=CC=C(OC)C2=C1C=CC=C2)=O
MCULE-5234076176	0.78	CCOC(C=CC1=CC(OC)=C(OCC)C=C1)=O
MCULE-5752702758	0.78	C(O)(=O)C=CC1=CC=CC(OC)=C1
MCULE-3400598023	0.78	C(=CC1=CC=CC(OCC)=C1)C(OCC)=O
MCULE-2527166131	0.78	C(=CC1C=CC=C(C=1)OC1=CC=CC=C1)C(OC)=O
MCULE-6328875398	0.77	C1(O)C=C(C(O)=CC=1)C=CC(=O)O
MCULE-9707776041	0.77	CCOC(C=CC1=CC=C(OCC)C=C1)=O
MCULE-3659200170	0.77	C1(=CC=C(/C=C(\C(=O)OC)/C(=O)OC)C=C1)O
MCULE-8793591909	0.77	C(OC(C)C)(=O)C=CC1=CC=CC(OCC)=C1
MCULE-5289107821	0.77	C(OCC)(C=CC1=CC(OC)=CC(OC)=C1)=O
MCULE-9346625991	0.77	COC(C(C#N)=CC1=CC(O)=CC=C1)=O
MCULE-2483911454	0.77	C1C=C(/C=C/C(=O)OC)C=CC=1
MCULE-1030097873	0.77	COC(C=CC1=CC=CC=C1)=O
MCULE-2090134479	0.77	C1(O)C=C(/C=C/C(=O)O)C(O)=CC=1
MCULE-5170571415	0.76	COC1=C(OC(C)C)C=CC(C=CC(OC(C)C)=O)=C1
MCULE-5384523851	0.76	CCOC(C=CC1=CC(OC)=C(OC(C)C)C=C1)=O
MCULE-6465000630	0.76	C1C=C(/C=C/C(=O)OCC)C=CC=1
MCULE-8395432408	0.76	CCOC(C=CC1=CC=CC=C1)=O
MCULE-2717097631	0.76	C(=CC1C=CC(=C(Cl)C=1)O)C(OC)=O
MCULE-8999355764	0.76	C1=C(O)C(C=CC(=O)OC(C)C)=CC=C1
MCULE-1335506941	0.76	COC1C(O)=C(OC)C=C(/C=C/C(=O)O)C=1
MCULE-4807121652	0.76	C1(O)=C(C)C=C(C=C1OC)C([H])=C([H])C(O)=O
MCULE-5892286449	0.76	C(OCCC1=CC=CC=C1)(=O)/C=C/C1=CC=C(O)C(O)=C1
MCULE-6112659813	0.76	COC1=C(O)C(OC)=CC(C=CC(O)=O)=C1
MCULE-5129503846	0.76	C1(=CC2=CC=CC=C2C=C1O)C=CC(OCC)=O
MCULE-4915693180	0.76	C(OC(C)C)(=O)C=CC1=CC=C(C=C1)OCC
MCULE-7815011628	0.76	CCOC(C=CC1=CC(OCC)=C(OCC)C=C1)=O
MCULE-5902675061	0.76	C(OC(C)C)(=O)C=CC1=CC=C(C(OC)=C1)OCC
MCULE-4178365007	0.76	C(OCCC1=CC=CC=C1)(=O)C=CC1=CC=C(O)C(O)=C1
MCULE-4172745258	0.75	C1(C=O)=CC(=CC=C1O)C=CC(OC)=O
MCULE-9113273606	0.75	C1C=C2C=C(C=CC(=O)OCC)C=CC2=CC=1
MCULE-5813337301	0.75	C(C1C=CC=C2C=CC=CC=12)=CC(OC)=O
MCULE-2560342671	0.75	C12C=C(C=CC=1OCO2)C=CC(OC)=O
MCULE-3604470298	0.75	C1(C=CC=CC=1)C=CC(=O)OC(C)C
MCULE-9897112956	0.75	C1(/C=C/C(OC(C)(C)C)=O)=CC=CC=C1
MCULE-6022384798	0.75	C1(OC)C=C(/C=C/COC)C=CC=1O
MCULE-2454886969	0.75	C1(O)C=C(/C=C/C(OCCCCCCCCCCCCCCCCCC)=O)C=CC=1O
MCULE-1723949511	0.75	C(OC(C)C)(=O)C=CC1C=CC(=C(OCC)C=1)OCC
MCULE-7037163379	0.75	COC(C=CC1=CC2=C(C=CC=C2)C=C1)=O
MCULE-9031259584	0.75	C1(=C2C=CC=CC2=CC2C=CC=CC1=2)C=CC(OC)=O
MCULE-3047237533	0.75	COC(C=CC1=CC(OC)=C(OCCO)C=C1)=O
MCULE-3283632849	0.75	C(C)(C(O)=O)=CC1C=CC(=C(OC)C=1)OC
MCULE-5301588795	0.75	C(=CC1C=CC=C(C=1)OC1C=CC=CC=1)C(OCC)=O
MCULE-6993960877	0.75	C(O)(=O)/C=C/C1=CC=C(C=C1)OC
MCULE-4456423689	0.75	C(O)(=O)C=CC1=CC=C(C=C1)OC
MCULE-1168886289	0.75	C(/C#N)(\C(O)=O)=C/C1C=CC(O)=C(O)C=1
MCULE-8914274512	0.75	C(CCCCCCCCCC)CCCCCCCCCCCOC(=O)/C=C/C1C=C(O)C(O)=CC=1
MCULE-7812166455	0.75	C(C1C=CC=C2C=CC=CC=12)=CC(OCC)=O
MCULE-1174854441	0.74	COC1=C(OC)C=C(C=CC(OCC#N)=O)C=C1
MCULE-2852384973	0.74	C(=CC1=CC=C(C(OC)=C1)OCC(C)C)C(OC)=O
MCULE-7614619109	0.74	C(OC(C)C)(=O)C=CC1C=CC=C(C=1)OC1C=CC=CC=1
MCULE-6800666719	0.74	C(O)(=O)C=CC1C=CC(=C(OC)C=1)OCC
MCULE-5153601925	0.74	COC(C=CC1=CC(OC)=C(OC(F)F)C=C1)=O
MCULE-8351376607	0.74	C1(OC)C(OC)=CC(=CC=1OC)/C=C/C(O)=O
MCULE-2475786053	0.74	O=C(/C=C/C1C=C(OC)C=C(O)C=1)O
MCULE-1952313672	0.74	C12C=CC=CC=1C(=CC=C2C=CC(O)=O)OC
MCULE-2475203381	0.74	C(=CC1C=CC(C)=CC=1)C(OC)=O
MCULE-9669475860	0.74	C1(OC)C(OC)=CC(=CC=1OC)C=CC(O)=O
MCULE-1766189090	0.74	C(=CC1=CC=C(C(OC)=C1)OCCC)C(OC)=O
MCULE-6200966556	0.74	C1=C(C=CC(=O)OC)C=CC(C=CC(=O)OC)=C1
MCULE-4680058595	0.74	COC1=CC(C=C(C(O)=O)C)=CC=C1
MCULE-9498783535	0.74	C(O)(=O)C=CC1C=CC=C(OCC)C=1
MCULE-3907582871	0.74	C(OC)(=O)/C=C/C1=CC=C(C)C=C1
MCULE-7768753045	0.73	[Na+].C1(OC)=CC(=CC(OC)=C1OC)C=CC([O-])=O
MCULE-2482402150	0.73	CCOC(C=CC1=CC2=C(OCO2)C=C1)=O
MCULE-3333629868	0.73	C(O)(=O)/C=C/C1C=C(OC)C=C(OC)C=1
MCULE-3201962056	0.73	CCOC1=C(OC)C=CC(C=CC(O)=O)=C1
MCULE-9284982880	0.73	C(O)(=O)/C=C/C1=CC=C(C=C1)OCC
MCULE-8506904750	0.73	COC(C=CC1=CC(C)=CC=C1)=O
MCULE-4995102542	0.73	C(C#N)(C(OC)=O)=CC1C=CC(=C(OC)C=1)O
MCULE-2800917117	0.73	C(O)(=O)C=CC1=CC=CC(OC(C)C)=C1
MCULE-9877794165	0.73	C(F)(F)(F)OC1=CC=C(C=C1)C=CC(OC)=O
MCULE-2740776573	0.73	C(O)(=O)C=CC1C=C(OC)C=C(OC)C=1
MCULE-1594342569	0.73	C(O)(=O)C=CC1=CC=C(C=C1)OCC
MCULE-4587107863	0.73	O=C(/C=C/C1C=CC=CC=1)OCC=C
MCULE-6561984320	0.73	O=C(OC)/C=C/C1C=CC=C(C)C=1
MCULE-6519208436	0.73	C(C#N)(=CC1C=CC(=CC=1)O)C(OC)=O
MCULE-9156764072	0.73	C(O)(=O)C=CC1=CC=C(C(OCC)=C1)OCC
MCULE-4978969608	0.73	CCOC(C=CC1=CC=C(C)C=C1)=O
MCULE-3880403828	0.73	C1C(C=CC(=O)OCC=C)=CC=CC=1
MCULE-9909014796	0.73	C1(C=CC=CC=1)C=C(C)C(=O)OC
MCULE-9574272269	0.73	O=C(/C=C/C1C(O)=C(OC)C=CC=1)O
MCULE-2542199611	0.73	C1(C=CC(=CC=1OC)C=CC(O)=O)OC(C)C
MCULE-4884367254	0.73	C(C1C=CC=C2C=CC=CC=12)=CC(OC(C)C)=O
MCULE-8276197336	0.73	COC(C=CC1=C(OC)C=CC(OC)=C1)=O
MCULE-6355537535	0.73	COCCOC1=C(OC)C=C(C=CC(OC)=O)C=C1
MCULE-5657158883	0.73	COC1=CC=C(OC(C=CC2=CC(OC)=C(OC)C=C2)=O)C=C1
MolPort-001-741-982	0.73	CC1OC(Oc2cc(O)c3c(oc(cc3=O)-c3ccc(O)cc3)c2C2OC(CO)C(O)C(O)C2O)C(O)C(O)C1O
MCULE-4027340164	0.72	C(=C/C1=CC=C(C=C1)O)(\C(O)=O)/C(O)=O
MCULE-5448240219	0.72	COC(C=CC1=C(F)C=C(O)C=C1)=O
MCULE-2004373121	0.72	CCCOC1=CC=C(C=CC(OCC)=O)C=C1
MCULE-6911603172	0.72	C1=C(OC)C(=CC(C=CC(=O)O)=C1)OC(C)C
MCULE-8054733396	0.72	CCCOC1=C(OC)C=C(C=CC(OCC)=O)C=C1
MCULE-3595855195	0.72	C(=O)(OC1=CC=CC=C1)C=CC1C=CC(=C(OCC)C=1)OCC
MCULE-5498733356	0.72	C(=CC1=CC=CC=C1)C(OCC=CC1C=CC=CC=1)=O
MCULE-2744888729	0.72	C(OC(C)C)(=O)C=CC1C=CC(=CC=1)OCCC
MCULE-6021519548	0.72	C(=O)(OC1=CC=C(C(C)=C1)C)C=CC1=CC=C(C(OC)=C1)OC
MCULE-6447164989	0.72	C1(=C(OC)C=CC(/C=C/C(=O)OC)=C1OC)OC
MCULE-5928432180	0.72	C(=CC1=CC=C(C=C1)OC)(C(OC)=O)C(O)=O
MCULE-2056837249	0.72	CC(OC(C=CC1=CC=C(C)C=C1)=O)C
MCULE-9572420523	0.72	C(=O)(OC1=CC=C(C=C1)C)C=CC1C=CC(=C(OCC)C=1)OCC
MCULE-1742179073	0.72	C(=O)(OC1=CC(C)=CC(C)=C1)C=CC1=CC=C(C(OC)=C1)OC
MCULE-1057313976	0.72	C(C)(=CC1=CC=C(C=C1)OC)C(O)=O
MCULE-8901806840	0.72	OC(/C=C/C1C=CC(O)=CC=1O)=O
MCULE-7439568885	0.72	C(C#N)(C(OCC)=O)=CC1=CC=CC(O)=C1
MCULE-8185613810	0.72	C1C=C(/C=C/C(=O)OC/C=C/C2C=CC=CC=2)C=CC=1
MCULE-9987567980	0.72	C1(C=C(C=CC=1O)/C=C/C(=O)C)O
MCULE-1719949673	0.72	C1C2=C(OCCO2)C=C(C=1)/C=C/C(=O)OC
MCULE-3070556455	0.72	C(CC)(=CC1C=CC=C(O)C=1)C(O)=O
MCULE-8734758113	0.72	C12C=C(C=CC=1OCCO2)C=CC(OC)=O
MCULE-2673913201	0.72	C1(OC)=C(OC)C=CC(=C1OC)C=CC(OC)=O
MCULE-6781383769	0.72	OC(C=CC1=CC=C(OCC=C)C=C1)=O
MCULE-3020705351	0.72	C12=CC=CC=C1C(=CC=C2C=CC(O)=O)OCC
MCULE-3239458209	0.72	COC1=CC2=C(C=C(C=C2)C=CC(O)=O)C=C1
MCULE-4474652685	0.72	COC1=C(O)C=CC(C=CC(OCC2=CC=C(COC(C=CC3=CC(OC)=C(O)C=C3)=O)C=C2)=O)=C1
MCULE-2705718395	0.72	COC1=C(OCC=C)C=CC(C=CC(O)=O)=C1
MCULE-5167468347	0.72	C(=O)(OC1C=CC=C(C)C=1)C=CC1=CC=C(C=C1)OC
MCULE-7674649726	0.72	C(O)(=O)C=CC1C=CC(=CC=1)OC(C)C
MCULE-3405575059	0.72	C(=O)(OC1=CC=C(C=C1)C)C=CC1C=CC(=CC=1)OC
MCULE-7505734728	0.72	C(=O)(OC1=CC=CC=C1)C=CC1=CC=C(C=C1)OCC
MCULE-9716894670	0.72	C(C1C=CC(=CC=1O)O)=CC(O)=O
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