Analog ID	Similarity score	SMILES	Selection options Mcule | MolPort | All | None
MolPort-003-846-030	1	Oc1ccc(\C=C\C(=O)NCCc2c[nH]c3ccc(O)cc23)cc1
MCULE-8110076741	1	C1=C(C=C2C(C[C@@H](OC(C3C=C(O)C(O)=C(O)C=3)=O)[C@@H](C3=CC=C(C(O)=C3)O)O2)=C1O)O
MCULE-3341525983	1	C1(=CC(=C2C(=C1)O[C@H](C1=CC(O)=C(O)C(O)=C1)[C@H](OC(C1C=C(O)C(O)=C(O)C=1)=O)C2)O)O
MCULE-2467245336	1	C1(O)=CC(O)=C2C(O[C@@H](C3C=C(O)C(O)=C(O)C=3)[C@@H](C2)OC(=O)C2C=C(O)C(O)=C(O)C=2)=C1
MCULE-1925476027	1	C1(O)C=C2O[C@@H](C3C=C(O)C(O)=C(O)C=3)[C@H](OC(=O)C3C=C(O)C(O)=C(O)C=3)CC2=C(O)C=1
MCULE-9356975267	1	C1(O)C=C2O[C@@H](C3C=CC(O)=C(O)C=3)[C@H](OC(C3C=C(O)C(O)=C(O)C=3)=O)CC2=C(O)C=1
MCULE-7760530136	1	O1[C@H](C2C=C(O)C(=C(O)C=2)O)[C@H](OC(=O)C2C=C(O)C(=C(O)C=2)O)CC2=C(C=C(O)C=C12)O
MCULE-4110327431	1	[C@@H]1(OC2=C(C(O)=CC(O)=C2)C[C@H]1OC(=O)C1C=C(C(O)=C(O)C=1)O)C1=CC=C(O)C(O)=C1
MCULE-3978866251	1	[C@H]1(OC2=C(C(O)=CC(O)=C2)C[C@H]1OC(=O)C1C=C(C(O)=C(O)C=1)O)C1=CC=C(O)C(O)=C1
MCULE-8215821193	1	C1C2=C(C[C@@H]([C@@H](O2)C2C=C(O)C(O)=C(O)C=2)OC(C2C=C(O)C(O)=C(O)C=2)=O)C(O)=CC=1O
MCULE-9913176697	1	OC1C=C2C(CC(C(C3C=CC(O)=C(O)C=3)O2)OC(C2C=C(O)C(O)=C(O)C=2)=O)=C(O)C=1
MCULE-9752626908	1	O1C(C2C=C(O)C(=C(O)C=2)O)C(OC(=O)C2C=C(O)C(=C(O)C=2)O)CC2=C(C=C(O)C=C12)O
MCULE-9046067244	1	C1(=CC(=C2C(=C1)O[C@H](C1=CC(O)=C(O)C(O)=C1)[C@@H](OC(C1C=C(O)C(O)=C(O)C=1)=O)C2)O)O
MCULE-4221565922	0.97	C1(O)C=C2O[C@H](C3C=C(O)C(O)=C(O)C=3)[C@H](OC(=O)C3C=C(OC)C(O)=C(O)C=3)CC2=C(O)C=1
MCULE-9566890994	0.97	C1(O)C=C2O[C@H](C3C=CC(O)=C(O)C=3)[C@H](OC(=O)C3C=C(OC)C(O)=C(O)C=3)CC2=C(O)C=1
MCULE-4382912006	0.97	C1(O)C=C2O[C@H](C3C=CC(O)=CC=3)[C@H](OC(=O)C3C=C(O)C(O)=C(O)C=3)CC2=C(O)C=1
MolPort-001-736-472	0.94	COc1ccc2[nH]cc(CCNC(=O)\C=C\c3ccccc3)c2c1
MolPort-044-567-482	0.93	Oc1ccc(\C=C\C(=O)NCCc2c[nH]c3ccccc23)cc1O
MolPort-044-567-482	0.93	Oc1ccc(\C=C\C(=O)NCCc2c[nH]c3ccccc23)cc1O
MolPort-000-820-375	0.90	COc1ccc(\C=C\C(=O)NCCc2c[nH]c3cc(OC)ccc23)cc1
MolPort-039-338-449	0.90	COc1cc(\C=C\C(=O)NCCc2c[nH]c3ccc(O)cc23)ccc1O
MolPort-039-338-448	0.90	COc1cc(\C=C/C(=O)NCCc2c[nH]c3ccc(O)cc23)ccc1O
MolPort-039-338-449	0.90	COc1cc(\C=C\C(=O)NCCc2c[nH]c3ccc(O)cc23)ccc1O
MolPort-001-759-413	0.90	O=C(NCCc1c[nH]c2ccccc12)\C=C\c1ccccc1
MolPort-006-756-042	0.90	O=C(NCCc1c[nH]c2ccccc12)C=Cc1ccccc1
MolPort-039-338-448	0.90	COc1cc(\C=C/C(=O)NCCc2c[nH]c3ccc(O)cc23)ccc1O
MolPort-001-823-134	0.90	CCOc1ccc(\C=C\C(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-000-912-024	0.89	COc1ccc(\C=C\C(=O)NCCc2c[nH]c3ccc(C)cc23)cc1
MolPort-000-818-206	0.89	COc1ccc2c(CCNC(=O)\C=C\c3ccccc3)c[nH]c2c1
MolPort-003-003-748	0.89	COc1ccc2[nH]cc(CCNC(=O)\C=C\c3ccccc3C)c2c1
MolPort-039-338-450	0.88	COc1cc(\C=C\C(=O)NCCc2c[nH]c3ccccc23)ccc1O
MolPort-006-753-893	0.88	Brc1ccc(\C=C\C(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-002-884-860	0.88	CC(C)(C)c1ccc(\C=C\C(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-039-338-450	0.88	COc1cc(\C=C\C(=O)NCCc2c[nH]c3ccccc23)ccc1O
MCULE-6029890850	0.88	O[C@H]1[C@@H](C2C3C=C([C@@H]4[C@H](OC(C5=CC(O)=C(O)C(O)=C5)=O)CC5C(=CC(=CC=5O)O)O4)C=C(C(=O)C=3C(O)=C(O)C=2)O)OC2=CC(=CC(O)=C2C1)O
MCULE-4778304263	0.88	C12=C(O)C(O)=CC([C@@H]3[C@H](OC(=O)C4C=C(O)C(=C(O)C=4)O)CC4C(=CC(O)=CC=4O3)O)=C1C=C(C=C(O)C2=O)[C@@H]1[C@H](OC(=O)C2C=C(O)C(O)=C(O)C=2)CC2C(=CC(O)=CC=2O1)O
MolPort-000-814-238	0.87	Cc1ccc2[nH]cc(CCNC(=O)\C=C\c3ccccc3)c2c1
MCULE-6600418013	0.87	C1C2C(=CC(O)=CC=2O)OC(C2C=C3C(C4OC5C(=C(O)C=C(O)C=5)CC4OC(C4C=C(O)C(O)=C(O)C=4)=O)=CC(O)=C(O)C3=C(O)C(=O)C=2)C1OC(C1C=C(O)C(O)=C(O)C=1)=O
MolPort-000-813-347	0.86	COc1ccc(\C=C\C(=O)NCCc2c[nH]c3ccc(Cl)cc23)cc1
MolPort-006-782-344	0.86	Oc1ccc(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-000-839-980	0.86	COc1ccc(\C=C\C(=O)NCCc2c[nH]c3ccccc23)cc1OC
MolPort-001-887-916	0.86	Oc1ccc(\C=C(\C#N)C(=O)NCCc2c[nH]c3ccccc23)cc1
MCULE-4502863447	0.86	O([C@@H]1[C@@H](C2C=CC(O)=C(O)C=2)OC2C(C1=O)=C(O)C=C(OC)C=2)C(C)=O
MolPort-044-387-648	0.85	Brc1cccc(C=CC(=O)NCCc2c[nH]c3ccccc23)c1
MolPort-000-511-303	0.85	COc1ccc2c(CCNC(=O)\C=C\c3ccccc3C)c[nH]c2c1
MolPort-001-827-988	0.85	Cc1ccc(\C=C\C(=O)NCCc2c[nH]c3ccccc23)c(C)c1
MolPort-044-387-648	0.85	Brc1cccc(C=CC(=O)NCCc2c[nH]c3ccccc23)c1
MolPort-001-828-082	0.85	Clc1ccc(\C=C\C(=O)NCCc2c[nH]c3ccccc23)cc1
MCULE-1738451204	0.85	CC(OC1=CC2=C(CC(C(C3C=C(OC(=O)C)C(OC(=O)C)=C(OC(=O)C)C=3)O2)OC(C2=CC(OC(=O)C)=C(OC(=O)C)C(OC(=O)C)=C2)=O)C(OC(=O)C)=C1)=O
MolPort-000-821-343	0.84	COc1ccc2c(CCNC(=O)\C=C\c3ccc(OC)c(OC)c3)c[nH]c2c1
MolPort-000-821-908	0.84	Clc1ccc2[nH]cc(CCNC(=O)\C=C\c3ccccc3)c2c1
MolPort-044-207-746	0.84	Fc1ccc(C=CC(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-002-885-001	0.84	CC(C)Cc1ccc(\C=C\C(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-044-207-746	0.84	Fc1ccc(C=CC(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-009-459-923	0.84	O=C(NCCc1c[nH]c2ccccc12)C=Cc1cccc2cccnc12
MolPort-000-912-029	0.84	COc1ccc2c(CCNC(=O)\C=C\c3ccccc3OC)c[nH]c2c1
MolPort-002-530-117	0.83	COc1ccc(\C=C\C(=O)NCCc2c[nH]c3ccc(C)cc23)cc1OC
MolPort-000-817-462	0.83	COc1ccccc1\C=C\C(=O)NCCc1c[nH]c2ccc(C)cc12
MolPort-002-641-500	0.83	Cc1ccc2[nH]cc(CCNC(=O)\C=C\c3ccccc3C)c2c1
MCULE-8022818849	0.83	C1(=CC(=C2C(O[C@@H](C3=CC=C(C(O)=C3)O)[C@H](O)C2)=C1)O)OC(=O)C1=CC(O)=C(O)C(O)=C1
MolPort-002-563-204	0.82	COc1ccc(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)c2ccccc12
MolPort-002-967-545	0.82	COc1ccc(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-001-985-599	0.82	COc1ccc(\C=C(\C#N)C(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-001-832-623	0.82	CSc1ccc(\C=C\C(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-044-207-614	0.82	O=C(NCCc1c[nH]c2ccccc12)C=Cc1cccnc1
MolPort-044-207-614	0.82	O=C(NCCc1c[nH]c2ccccc12)C=Cc1cccnc1
MolPort-044-398-332	0.81	COc1ccc2[nH]cc(CCNC(=O)C=Cc3ccccn3)c2c1
MolPort-044-398-332	0.81	COc1ccc2[nH]cc(CCNC(=O)C=Cc3ccccn3)c2c1
MolPort-006-382-320	0.81	Cc1ccc2[nH]cc(CCNC(=O)\C=C\c3ccc(F)cc3)c2c1
MolPort-000-820-733	0.81	COc1ccc2c(CCNC(=O)\C=C\c3cccc(c3)C(F)(F)F)c[nH]c2c1
MolPort-002-640-488	0.81	COc1ccc(\C=C\C(=O)NCCc2c[nH]c3ccc(Cl)cc23)cc1OC
MolPort-044-242-459	0.80	O=C(CNC(=O)C=Cc1ccccc1)NCCc1c[nH]c2ccccc12
MolPort-044-242-459	0.80	O=C(CNC(=O)C=Cc1ccccc1)NCCc1c[nH]c2ccccc12
MolPort-002-967-551	0.80	CC(C)Oc1ccc(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-001-985-565	0.80	CC(C)Oc1ccc(\C=C(\C#N)C(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-002-642-431	0.80	COc1ccccc1\C=C\C(=O)NCCc1c[nH]c2ccc(Cl)cc12
MolPort-000-912-022	0.80	Cc1ccccc1\C=C\C(=O)NCCc1c[nH]c2ccc(Cl)cc12
MolPort-002-955-016	0.80	Oc1c(Cl)cc(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)cc1Cl
MolPort-002-600-645	0.80	Oc1ccc(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)cc1Br
MolPort-008-324-122	0.80	Cc1ccc2[nH]cc(CCNC(=O)\C=C\c3cccc(F)c3)c2c1
MCULE-5771493344	0.80	C1(O)C=C2O[C@H](C3C=CC=CC=3)[C@@H](OC(=O)C)C(=O)C2=C(O)C=1
MCULE-5749472487	0.79	C1(O)C=C2O[C@H](C3C=C(O)C(O)=C(O)C=3)[C@H](O)CC2=C(O)C=1
MCULE-4219942050	0.79	O1C(C(O)CC2C(=CC(O)=CC1=2)O)C1C=CC(O)=C(O)C=1
MCULE-1532117250	0.79	C1C(O)=C2C[C@@H]([C@H](OC2=CC=1O)C1C=C(O)C(O)=CC=1)O
MCULE-9338438267	0.79	C1(O)C=C2O[C@H]([C@H](CC2=C(O)C=1)O)C1C=C(O)C(O)=C(O)C=1
MCULE-3245144995	0.79	OC1=CC(O)=C2C(O[C@@H]([C@H](O)C2)C2C=C(O)C(O)=C(O)C=2)=C1
MCULE-9354240076	0.79	OC1=CC(=C2C(=C1)O[C@@H]([C@H](C2)O)C1=CC=C(C(=C1)O)O)O
MCULE-4522193885	0.79	C1(O)C=C2O[C@@H]([C@H](CC2=C(O)C=1)O)C1C=C(O)C(O)=C(O)C=1
MCULE-1292125513	0.79	O1[C@@H]([C@H](O)CC2C(=CC(O)=CC1=2)O)C1=CC=C(C(O)=C1)O
MolPort-000-862-255	0.79	C(Cc1c[nH]c2ccccc12)NC\C=C\c1ccccc1
MolPort-006-382-297	0.79	Cc1ccc2[nH]cc(CCNC(=O)\C=C\c3ccccc3F)c2c1
MolPort-002-967-546	0.79	COc1ccc(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)cc1C
MolPort-001-981-740	0.79	COc1ccc(\C=C(\C#N)C(=O)NCCc2c[nH]c3ccccc23)cc1C
MolPort-000-831-026	0.79	Cl.C(Cc1c[nH]c2ccccc12)NC\C=C\c1ccccc1
MCULE-8775451204	0.79	C1C(O)=C2C[C@@H](O)[C@H](OC2=CC=1O)C1C=C(C(=CC=1)O)O
MolPort-002-946-292	0.79	CC(C)COc1ccc(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)cc1
MCULE-8436122228	0.79	[C@@H]1([C@H](O)CC2C(O)=CC(O)=CC=2O1)C1=CC(=C(O)C(O)=C1)O
MCULE-9971134031	0.79	C1(O)C=C2O[C@@H](C3C=C(O)C(O)=C(O)C=3)[C@H](O)CC2=C(O)C=1
MolPort-009-031-554	0.78	CC(C)=CC(=O)NCCc1c[nH]c2ccccc12
MolPort-000-812-798	0.78	COc1ccc2c(CCNC(=O)\C=C\c3ccc4OCOc4c3)c[nH]c2c1
MolPort-002-600-653	0.78	COc1cccc(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)c1
MolPort-044-277-929	0.78	O=C(NCCc1c[nH]c2ccccc12)C1CCN(CC1)C(=O)C=Cc1ccccc1
MolPort-000-845-533	0.78	COc1ccc2c(CCNC(=O)\C=C\C)c[nH]c2c1
MolPort-044-277-929	0.78	O=C(NCCc1c[nH]c2ccccc12)C1CCN(CC1)C(=O)C=Cc1ccccc1
MolPort-044-277-909	0.78	O=C(NCCc1c[nH]c2ccccc12)C=Cc1ccc2OCCOc2c1
MolPort-044-239-462	0.78	FC(F)Oc1ccc(C=CC(=O)NCC(c2c[nH]c3ccccc23)c2ccccc2Cl)cc1
MCULE-2327386216	0.78	C1(O)C=C2O[C@H](C3C=C(O)C(O)=C(O)C=3)[C@@H](O)C(=O)C2=C(O)C=1
MolPort-044-243-036	0.78	CN(C)c1ccc(cc1)C(CNC(=O)C=Cc1ccc(Cl)cc1)c1c[nH]c2ccccc12
MCULE-4871721304	0.78	C12C(O)=CC(=CC=1O[C@H]([C@H](O)C2=O)C1C=CC(=C(O)C=1)O)O
MolPort-001-005-606	0.78	CCc1ccc(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)cc1
MCULE-1634327239	0.78	C1(OC(=O)C)C=C2O[C@H](C3C=CC(OC(=O)C)=C(OC(=O)C)C=3)[C@H](OC(=O)C)CC2=C(OC(=O)C)C=1
MolPort-044-243-036	0.78	CN(C)c1ccc(cc1)C(CNC(=O)C=Cc1ccc(Cl)cc1)c1c[nH]c2ccccc12
MCULE-2692728789	0.78	C12C(O)=CC(=CC=1O[C@@H]([C@@H](O)C2=O)C1C=CC(=C(O)C=1)O)O
MolPort-044-239-462	0.78	FC(F)Oc1ccc(C=CC(=O)NCC(c2c[nH]c3ccccc23)c2ccccc2Cl)cc1
MCULE-2394173874	0.78	C12C(O)=CC(=CC=1O[C@@H]([C@@H](O)C2=O)C1C=CC(=C(O)C=1)O)O
MolPort-000-515-967	0.78	COc1ccc2c(CCNC(=O)\C=C\c3ccc(cc3)[N+]([O-])=O)c[nH]c2c1
MCULE-4254870575	0.78	C12C(O)=CC(=CC=1OC(C(O)C2=O)C1C=CC(=C(O)C=1)O)O
MolPort-044-277-909	0.78	O=C(NCCc1c[nH]c2ccccc12)C=Cc1ccc2OCCOc2c1
MCULE-1617162545	0.78	C1(OC(=O)C)C=C2O[C@H](C3C=CC(OC(=O)C)=C(OC(=O)C)C=3)[C@@H](OC(=O)C)CC2=C(OC(=O)C)C=1
MolPort-001-909-081	0.78	CCc1ccc(\C=C(\C#N)C(=O)NCCc2c[nH]c3ccccc23)cc1
MCULE-2567986775	0.78	O1C2=CC(=CC(=C2C([C@H]([C@@H]1C1=CC=C(C(=C1)O)O)O)=O)O)O
MCULE-2296975795	0.78	C12=C(O)C=C(C=C1O[C@@H]([C@@H](O)C2=O)C1=CC(O)=C(C(O)=C1)O)O
MCULE-2809167723	0.78	C12=C(O)C=C(C=C1OC(C(O)C2=O)C1=CC(O)=C(C(O)=C1)O)O
MCULE-6698156528	0.78	O1C2=CC(=CC(=C2C([C@@H]([C@@H]1C1=CC(=C(C(=C1)O)O)O)O)=O)O)O
MolPort-002-337-627	0.78	CC(C)(C)c1ccc(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-002-508-901	0.78	C\C=C\C(=O)NCCc1c[nH]c2ccccc12
MolPort-016-615-532	0.77	CCN(C\C=C\c1ccccc1)C(=O)Cc1c[nH]c2ccccc12
MolPort-000-912-056	0.77	Cc1ccc2[nH]cc(CCNC(=O)\C=C\c3ccc4OCOc4c3)c2c1
MolPort-044-388-815	0.77	O=C(CN1CCN(CC=Cc2ccccc2)CC1)NCCc1c[nH]c2ccccc12
MolPort-028-611-164	0.77	Cn1cc(C(O)CNC(=O)\C=C\c2ccccc2)c2ccccc12
MCULE-5340165807	0.77	C1(O)C=C2OC(C(C(=O)C2=CC=1)O)C1C=C(O)C(O)=C(O)C=1
MolPort-002-946-239	0.77	O=C(NCCc1c[nH]c2ccccc12)C(=C\c1ccc(OCC#C)cc1)\C#N
MCULE-3231582881	0.77	[C@H]1([C@@H](O)C(C2C=CC(O)=CC=2O1)=O)C1C=CC(O)=C(O)C=1
MolPort-028-270-489	0.77	COc1ccc2[nH]cc(CCNC(=O)C=CC=CC)c2c1
MCULE-9634821184	0.77	O1C2C=C(O)C=CC=2C([C@H](O)[C@H]1C1=CC(O)=C(C(O)=C1)O)=O
MolPort-045-967-799	0.77	COc1ccc2[nH]cc(CCN3C(=O)C=C(C)C3=O)c2c1
MCULE-7062463801	0.77	C1(OC(=O)C)C=C2O[C@H](C3C=CC=CC=3)[C@@H](OC(=O)C)C(=O)C2=C(O)C=1
MolPort-002-335-644	0.77	CN(C)c1ccc(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)cc1
MCULE-5665116242	0.77	C1(O)C=C2O[C@H](C3C=CC(O)=C(O)C=3)[C@@H](O)C(=O)C2=CC=1
MolPort-001-985-562	0.77	CN(C)c1ccc(\C=C(\C#N)C(=O)NCCc2c[nH]c3ccccc23)cc1
MCULE-7845274541	0.77	C1(=O)C(OC(C)=O)C(C2=CC=C(C(OC(C)=O)=C2)OC(C)=O)OC2C=C(OC(C)=O)C=C(O)C1=2
MolPort-044-397-028	0.77	COc1ccc(cc1)C(CNC(=O)C=Cc1ccc2OCOc2c1)c1c[nH]c2ccccc12
MolPort-028-895-692	0.77	CCC=C(C)C(=O)NCCc1c[nH]c2ccc(OC)cc12
MolPort-044-388-815	0.77	O=C(CN1CCN(CC=Cc2ccccc2)CC1)NCCc1c[nH]c2ccccc12
MolPort-044-397-028	0.77	COc1ccc(cc1)C(CNC(=O)C=Cc1ccc2OCOc2c1)c1c[nH]c2ccccc12
MolPort-028-895-692	0.77	CCC=C(C)C(=O)NCCc1c[nH]c2ccc(OC)cc12
MolPort-028-611-164	0.77	Cn1cc(C(O)CNC(=O)\C=C\c2ccccc2)c2ccccc12
MolPort-045-967-799	0.77	COc1ccc2[nH]cc(CCN3C(=O)C=C(C)C3=O)c2c1
MolPort-028-270-489	0.77	COc1ccc2[nH]cc(CCNC(=O)C=CC=CC)c2c1
MCULE-4204496934	0.76	C1(OC)C=C2O[C@H](C3C=CC(OC)=C(O)C=3)[C@@H](O)CC2=C(OC)C=1
MCULE-6991857034	0.76	OC1C=CC([C@@H]2OC3=CC(O)=C(C)C(O)=C3C([C@H]2O)=O)=CC=1O
MCULE-1338747805	0.76	C1(O)C=C2O[C@H](C3C=CC(O)=C(O)C=3)[C@@H](O)C(=O)C2=C(O)C=1C
MCULE-4817576208	0.76	C1(O)C=C2O[C@H](C3C=C(O)C(O)=C(O)C=3)[C@@H](O)C(=O)C2=C(O)C=1C
MCULE-2605725094	0.76	C1(O)C=C2O[C@H](C3C=C(O)C(OC)=C(O)C=3)[C@@H](O)C(=O)C2=CC=1
MCULE-1480766301	0.76	C1(OC)=CC(O)=C2C([C@@H]([C@@H](C3C=CC(O)=C(O)C=3)OC2=C1)O)=O
MCULE-1856015315	0.76	O(C)C1C=CC([C@H]2OC3=CC(O)=CC(O)=C3C([C@@H]2O)=O)=CC=1O
MCULE-8224104004	0.76	C1(OC)C=C2O[C@H](C3C=CC(OC)=C(O)C=3)[C@@H](O)C(=O)C2=C(O)C=1
MolPort-002-966-578	0.76	Brc1cccc(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)c1
MCULE-4812868362	0.76	OC1C(O)=CC([C@@H]2OC3C(C([C@H]2O)=O)=C(O)C(C)=C(O)C=3)=CC=1O
MolPort-003-941-553	0.76	COc1ccc(CNC(=O)\C=C\c2ccc3[nH]cc(CCN(C)C)c3c2)cc1
MolPort-044-396-780	0.76	COc1ccc(C=CC(=O)NCC(c2c[nH]c3ccccc23)c2ccccc2Cl)cc1OC
MolPort-000-824-063	0.76	COc1ccc2c(CCNC(=O)\C=C\c3cccc(c3)[N+]([O-])=O)c[nH]c2c1
MolPort-002-558-885	0.76	COc1ccc2[nH]cc(C(=O)CN3CCN(C\C=C\c4ccccc4)CC3)c2c1
MolPort-002-566-581	0.76	Cc1ccccc1\C=C(/C#N)C(=O)NCCc1c[nH]c2ccccc12
MolPort-028-933-854	0.76	[O-][N+](=O)c1cccc(C=CC(=O)NCCc2c[nH]c3ccccc23)c1
MolPort-020-135-322	0.76	CC(C)=CC(=O)NCCc1c[nH]c2cc(C)ccc12
MolPort-000-799-422	0.76	COc1ccccc1\C=C(/C#N)C(=O)NCCc1c[nH]c2ccccc12
MolPort-001-985-613	0.76	COc1ccc2ccccc2c1\C=C(/C#N)C(=O)NCCc1c[nH]c2ccccc12
MolPort-044-396-728	0.76	O=C(NCC(c1c[nH]c2ccccc12)c1ccccc1)C=Cc1ccc2OCOc2c1
MolPort-020-135-322	0.76	CC(C)=CC(=O)NCCc1c[nH]c2cc(C)ccc12
MolPort-044-396-728	0.76	O=C(NCC(c1c[nH]c2ccccc12)c1ccccc1)C=Cc1ccc2OCOc2c1
MolPort-028-933-854	0.76	[O-][N+](=O)c1cccc(C=CC(=O)NCCc2c[nH]c3ccccc23)c1
MolPort-044-396-780	0.76	COc1ccc(C=CC(=O)NCC(c2c[nH]c3ccccc23)c2ccccc2Cl)cc1OC
MCULE-5875158888	0.75	C1(=O)C(OC(C)=O)C(C2C=CC(=C(OC(C)=O)C=2)OC(C)=O)OC2=CC(OC(C)=O)=CC(OC(C)=O)=C12
MolPort-002-332-719	0.75	Clc1ccc(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)cc1Cl
MolPort-001-985-582	0.75	CCN(CC)c1ccc(\C=C(\C#N)C(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-000-802-607	0.75	Cc1ccc2[nH]cc(CCNC(=O)\C=C\c3ccc(cc3)[N+]([O-])=O)c2c1
MolPort-002-563-710	0.75	O=C(NCCc1c[nH]c2ccccc12)C(=C/c1ccc(cc1)C#N)\C#N
MolPort-044-398-785	0.75	CN(C)c1ccc(cc1)C(CNC(=O)C=Cc1cccc(F)c1)c1c[nH]c2ccccc12
MolPort-001-736-385	0.75	CC(=O)NCCc1c[nH]c2ccc(O)cc12
MolPort-002-565-107	0.75	Clc1ccc(\C=C(\C#N)C(=O)NCCc2c[nH]c3ccccc23)cc1Cl
MolPort-002-967-550	0.75	COc1cc(OC)c(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)c(OC)c1
MolPort-006-754-347	0.75	CC(C)C=CC(=O)NCCc1c[nH]c2ccccc12
MolPort-002-332-712	0.75	O=C(NCCc1c[nH]c2ccccc12)C(=C\c1ccc(cc1)C#N)\C#N
MolPort-003-002-601	0.75	Clc1ccc2[nH]cc(CCNC(=O)\C=C\c3ccc4OCOc4c3)c2c1
MolPort-044-239-312	0.75	COc1ccc(OC)c(C=CC(=O)NCC(c2c[nH]c3ccccc23)c2ccc(cc2)N(C)C)c1
MolPort-044-398-785	0.75	CN(C)c1ccc(cc1)C(CNC(=O)C=Cc1cccc(F)c1)c1c[nH]c2ccccc12
MolPort-044-239-312	0.75	COc1ccc(OC)c(C=CC(=O)NCC(c2c[nH]c3ccccc23)c2ccc(cc2)N(C)C)c1
MolPort-002-966-638	0.75	O=C(NCCc1c[nH]c2ccccc12)C(=C\c1cccc(Oc2ccccc2)c1)\C#N
MolPort-002-967-547	0.75	CCN(CC)c1ccc(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)cc1
MCULE-9218975393	0.74	[C@H]1([C@@H](O)[C@@H](C2=CC=C(O)C=C2O1)O)C1C=CC(O)=C(O)C=1
MCULE-3935146797	0.74	[C@@H]1([C@H](O)[C@H](C2=CC=C(O)C=C2O1)O)C1C=CC(O)=C(O)C=1
MCULE-1366630724	0.74	C1(OC)C=C2O[C@H](C3C=CC(O)=C(OC)C=3)[C@H](O)CC2=C(OC)C=1
MCULE-8148398497	0.74	[C@H]1(OC2C(=CC=CC=2)C(=O)[C@H]1OC(=O)C)C1C=CC=CC=1
MCULE-6382811837	0.74	O1[C@H]([C@H](O)CC2C(=CC(OC)=CC1=2)OC)C1C=CC(=C(OC)C=1)OC
MolPort-009-115-530	0.74	O=C(CNC(=O)C=Cc1cccnc1)NCCc1c[nH]c2ccccc12
MolPort-000-712-694	0.74	CCOc1ccc(\C=C(\NC(C)=O)C(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-002-966-640	0.74	CCc1ccccc1\C=C(/C#N)C(=O)NCCc1c[nH]c2ccccc12
MolPort-002-597-849	0.74	CSc1ccc(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-001-890-884	0.74	OC(=O)\C=C\C(=O)NCCc1c[nH]c2ccccc12
MolPort-018-566-710	0.74	COc1ccc2c(CCNC(=O)C=C)c[nH]c2c1
MolPort-002-567-182	0.74	Clc1ccccc1\C=C(/C#N)C(=O)NCCc1c[nH]c2ccccc12
MolPort-028-275-828	0.74	CN(CCc1ccncc1)C(=O)C=Cc1ccnc2ccccc12
MolPort-002-337-626	0.74	O=C(NCCc1c[nH]c2ccccc12)C(=C\c1c[nH]c2ccccc12)\C#N
MolPort-012-145-038	0.74	C=CC(=O)NCCc1c[nH]c2ccccc12
MolPort-044-283-645	0.74	Clc1cc(C=CC(=O)NCCc2c[nH]c3ccccc23)cc2OCOc12
MolPort-044-283-645	0.74	Clc1cc(C=CC(=O)NCCc2c[nH]c3ccccc23)cc2OCOc12
MolPort-028-810-947	0.74	[O-][N+](=O)c1ccccc1C=CC(=O)NCCc1c[nH]c2ccccc12
MolPort-028-275-828	0.74	CN(CCc1ccncc1)C(=O)C=Cc1ccnc2ccccc12
MolPort-028-810-947	0.74	[O-][N+](=O)c1ccccc1C=CC(=O)NCCc1c[nH]c2ccccc12
MCULE-3493265138	0.73	C12C(OC)=CC(=CC=1OC(C(O)C2=O)C1C=CC(=C(OC)C=1)OC)OC
MCULE-5454789546	0.73	C1(C(=O)C2C=CC=CC=2OCC2=CC=CC=C2)C(O1)C1=CC=C2C(OCCO2)=C1
MCULE-1804962504	0.73	[C@H]1(OC2=C(C=CC=C2)C(=O)[C@H]1OC(=O)CCC)C1=CC=CC=C1
MCULE-6148416904	0.73	C12=C(Br)C(OCC3=CC=CC=C3)=CC(OCC3C=CC=CC=3)=C1C[C@H](OCC1C=CC=CC=1)[C@@H](C1C=CC(=C(OCC3C=CC=CC=3)C=1)OCC1C=CC=CC=1)O2
MolPort-002-966-641	0.73	COc1ccc(\C=C\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-044-301-627	0.73	COC(=O)COc1ccc(C=C(C#N)C(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-000-790-066	0.73	COc1ccc(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)c(OC)c1C
MolPort-002-332-695	0.73	COC(=O)COc1ccc(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-000-838-174	0.73	[O-][N+](=O)c1ccc(\C=C\C(=O)NCCc2c[nH]c3ccc(Cl)cc23)cc1
MolPort-002-332-706	0.73	Fc1ccccc1\C=C(/C#N)C(=O)NCCc1c[nH]c2ccccc12
MolPort-002-546-222	0.73	O=C(CN1CCN(C\C=C\c2ccccc2)CC1)c1c[nH]c2ccccc12
MolPort-002-673-088	0.73	O=C(Cc1c[nH]c2ccccc12)N1CCN(C\C=C\c2ccccc2)CC1
MolPort-002-337-319	0.73	OC(=O)c1ccc(COc2ccc(\C=C(/C#N)C(=O)NCCc3c[nH]c4ccccc34)cc2)cc1
MolPort-002-948-220	0.73	O=C(NCCc1c[nH]c2ccccc12)C(=C\c1cccnc1)\C#N
MolPort-001-981-760	0.73	COc1cc(\C=C(\C#N)C(=O)NCCc2c[nH]c3ccccc23)cc(Cl)c1OC
MolPort-002-967-548	0.73	COc1cc(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)cc(Cl)c1OC
MolPort-002-895-845	0.73	Clc1cccc(Cl)c1\C=C(/C#N)C(=O)NCCc1c[nH]c2ccccc12
MolPort-044-301-627	0.73	COC(=O)COc1ccc(C=C(C#N)C(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-001-981-739	0.73	COC(=O)COc1ccc(\C=C(\C#N)C(=O)NCCc2c[nH]c3ccccc23)cc1
MCULE-8379030042	0.72	C12=C(O)C=C(C=C1O[C@]([C@@]([H])(O)C2=O)([H])C1C=CC2=C(C=1)O[C@]([C@@]([H])(CO)O2)([H])C1=CC=C(C(OC)=C1)O)O
MCULE-4152291525	0.72	C12C(O)=CC(=CC=1O[C@@]([C@]([H])(O)C2=O)([H])C1C=CC2=C(C=1)O[C@]([C@@]([H])(CO)O2)([H])C1C=CC(=C(OC)C=1)O)O
MCULE-5229560297	0.72	O[C@H]1[C@H](C2C3O[C@@H]([C@H](CC=3C(O)=CC=2O)O)C2C=C(O)C(O)=CC=2)C2C(=CC(=CC=2O[C@@H]1C1C=C(O)C(O)=CC=1)O)O
MCULE-9566565950	0.72	O=C1C2C(=CC(=CC=2O[C@H](C2C=C3C(O[C@H]([C@H](O3)C3C=C(OC)C(O)=CC=3)CO)=CC=2)[C@H]1O)O)O
MCULE-7201821938	0.72	C12C(O)=CC(=CC=1OC(C(O)C2=O)C1C=CC2=C(C=1)OC(C(CO)O2)C1=CC=C(C(OC)=C1)O)O
MCULE-9862512162	0.72	[C@H]1(C2=CC=C(O)C=C2)OC2=CC(O)=CC(O)=C2C[C@H]1O
MCULE-6637888420	0.72	O1C2C=C(C=CC=2O[C@@H](CO)[C@@H]1C1=CC=C(C(=C1)OC)O)[C@H]1[C@H](C(C2=C(C=C(C=C2O1)O)O)=O)O
MCULE-6390383057	0.72	COC1C=C(C2C(CO)OC3C=C(C4C(O)C(=O)C5C(=CC(=CC=5O)O)O4)C=CC=3O2)C=CC=1O
MCULE-4879610005	0.72	C1(O)C=C2O[C@H](C3C=C(O)C(O)=CC=3)[C@H](O)[C@@H](C3C(O)=CC(O)=C4C[C@H](O)[C@@H](C5C=C(O)C(O)=CC=5)OC4=3)C2=C(O)C=1
MCULE-5581625093	0.72	C1(O)C=C2OC(C3C=C(O)C(O)=CC=3)C(OC3(C4C=C(O)C(O)=CC=4)OC4=CC(O)=CC(O)=C4C(O)C3O)CC2=C(O)C=1
MCULE-4054125595	0.72	C1(O)C=C2O[C@H](C3C=CC(O)=CC=3)[C@H](O)CC2=C(O)C=1
MCULE-9092075985	0.72	C1(O)C=C2O[C@H](C3C=CC4O[C@H](C5C=CC(OC)=C(O)C=5)[C@@H](CO)OC=4C=3)[C@@H](O)C(=O)C2=C(O)C=1
MCULE-9581242889	0.72	C1(O)C=C2O[C@H](C3C=CC(O)=CC=3)[C@@H](O)CC2=C(O)C=1
MCULE-2360599707	0.72	O[C@H]1[C@H](C2=C(O)C=C(O)C3=C2O[C@H](C2C=CC(O)=C(O)C=2)[C@@H](C3)O)C2C(=CC(=CC=2O)O)O[C@@H]1C1C=CC(O)=C(O)C=1
MCULE-7364169831	0.72	C1(O)C=C2O[C@H](C3C=C(O)C(O)=CC=3)[C@H](O)[C@@H](C3C(O)=CC(O)=C4C[C@@H](O)[C@@H](C5C=C(O)C(O)=CC=5)OC4=3)C2=C(O)C=1
MCULE-6463439345	0.72	C12=C(O)C=C(C=C1O[C@]([C@@]([H])(O)C2=O)([H])C1C=CC2=C(C=1)O[C@]([C@@]([H])(CO)O2)([H])C1=CC=C(C(OC)=C1)O)O
MCULE-3987657618	0.72	C1(O)C=C2O[C@@H](C3C=CC(O)=CC=3)[C@@H](O)CC2=C(O)C=1
MolPort-044-396-730	0.72	[O-][N+](=O)c1cccc(C=CC(=O)NCC(c2c[nH]c3ccccc23)c2ccccc2)c1
MolPort-023-005-486	0.72	C\C(=C/C(=O)NCCc1c[nH]c2ccccc12)C(O)=O
MolPort-044-223-555	0.72	COc1ccc(C=CC(=O)NCC(C)(C)c2ccncc2)cc1O
MolPort-003-033-221	0.72	COc1ccc2cc(CCNC(=O)\C=C/c3ccccc3)c(=O)[nH]c2c1
MolPort-007-874-602	0.72	COc1ccc2[nH]cc(CCNC(=O)C3=Cc4ccccc4OC3)c2c1
MolPort-002-966-580	0.72	COc1cc(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)ccc1OCC=C
MolPort-044-396-730	0.72	[O-][N+](=O)c1cccc(C=CC(=O)NCC(c2c[nH]c3ccccc23)c2ccccc2)c1
MolPort-006-754-349	0.72	[O-][N+](=O)c1cc(\C=C\C(=O)NCCc2c[nH]c3ccccc23)ccc1Cl
MolPort-000-840-433	0.72	[O-][N+](=O)c1cccc(\C=C\C(=O)NCCc2c[nH]c3ccc(Cl)cc23)c1
MolPort-002-335-643	0.72	COC(=O)c1ccc(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-008-341-819	0.72	COc1ccc2[nH]cc(\C=C(/C#N)C(=O)NCCc3ccccc3)c2c1
MolPort-003-033-117	0.72	Cc1ccc2cc(CCNC(=O)\C=C/c3ccccc3)c(=O)[nH]c2c1
MolPort-003-002-596	0.72	Cc1ccc2[nH]cc(CCNC(=O)C=C)c2c1
MolPort-002-174-760	0.72	Oc1ccc(\C=C(\NC(=O)c2ccccc2)C(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-002-967-291	0.72	CCOC(=O)COc1ccc(\C=C(\C#N)C(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-002-568-936	0.72	COc1cc(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)cc(Br)c1O
MolPort-003-823-711	0.72	O=C1NC(=O)C(=C1c1c[nH]c2ccccc12)c1c[nH]c2ccccc12
MolPort-002-756-893	0.72	Cn1cc(\C=C\C(=O)NCCc2c[nH]c3ccccc23)cn1
MolPort-044-223-555	0.72	COc1ccc(C=CC(=O)NCC(C)(C)c2ccncc2)cc1O
MolPort-001-981-759	0.72	O=C(NCCc1c[nH]c2ccccc12)C(=C/c1ccc2OCOc2c1)\C#N
MolPort-002-332-758	0.72	O=C(NCCc1c[nH]c2ccccc12)C(=C\c1ccc2OCOc2c1)\C#N
MolPort-000-826-655	0.72	Cl.O=C(Cc1c[nH]c2ccccc12)N1CCN(C\C=C\c2ccccc2)CC1
MolPort-010-898-064	0.72	Cn1cc2CCN(Cc3cccc1c23)C(=O)\C=C\c1ccccc1
MolPort-002-768-576	0.72	COc1ccc2[nH]cc(CCNC(=O)\C=C\c3cnn(C)c3)c2c1
MolPort-023-005-486	0.72	C\C(=C/C(=O)NCCc1c[nH]c2ccccc12)C(O)=O
MCULE-6477005466	0.71	O=C1C2C(=C(C=C(C=2O)O)[C@H]2OC3C=C(C=C(O)C=3C[C@H]2O)O)C=C([C@H]2OC3C=C(C=C(O)C=3C[C@H]2O)O)C=C1O
MCULE-6543286448	0.71	O=C1C2C(=C(C=C(C=2O)O)[C@H]2OC3C=C(C=C(O)C=3C[C@H]2O)O)C=C([C@H]2OC3C=C(C=C(O)C=3C[C@H]2O)O)C=C1O
MCULE-8635359097	0.71	C1(O)C=C2O[C@H](C3C=CC(O)=C(O)C=3)CC(=O)C2=CC=1O
MCULE-6429597192	0.71	C1(O)C=C2O[C@H](C3C=CC(O)=CC=3)[C@@H](O)C(=O)C2=C(O)C=1
MCULE-9072285894	0.71	O[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]1O[C+]1CC2C(=CC(=CC=2OC1C1C=C(O)C(O)=CC=1)O)O
MCULE-9355206787	0.71	C1(O)C=C2O[C@H](C3C=CC(O)=C(O)C=3)[C@@H](O[C@H]3[C@H](O)[C@@H](O)[C@H](O)CO3)C(=O)C2=C(O)C=1
MCULE-3974580137	0.71	C1(O)C=C2O[C@H](C3C=CC(O)=C(O)C=3)[C@@H](O[C@H]3[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O3)CC2=C(O)C=1
MCULE-1313319901	0.71	C1(O)C=C2OC(C3C=CC(O)=C(O)C=3)C(OC3C(O)C(O)C(O)CO3)C(=O)C2=C(O)C=1
MCULE-7376385188	0.71	C1(=O)C(OC(C)=O)C(OC2C=C(C=C(OC(C)=O)C1=2)OC(C)=O)C1C=CC2=C(C=1)OC(C(COC(C)=O)O2)C1C=CC(=C(OC)C=1)OC(C)=O
MCULE-3029164834	0.71	C1(O)C=C2O[C@H]([C@H](O)C(C2=C(O)C=1)=O)C1C=CC(O)=CC=1
MCULE-5017083843	0.71	C1(=O)C(OC(C)=O)[C@@H](C2C=CC3=C(C=2)OC([C@@H](COC(C)=O)O3)C2C=CC(=C(OC)C=2)OC(C)=O)OC2C=C(OC(C)=O)C=C(OC(C)=O)C1=2
MCULE-5901955895	0.71	O(C1C(C2C=CC(O)=C(O)C=2)OC2C(=C(C=C(O)C=2)O)C1)[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
MolPort-046-600-330	0.71	C=CC(=O)NCCc1c[nH]c2ccc(OCc3ccccc3)cc12
MolPort-002-966-725	0.71	O=C(NCCc1c[nH]c2ccccc12)C(=C\c1ccc2OCCOc2c1)\C#N
MolPort-009-167-953	0.71	COc1ccc(CCNC(=O)C=Cc2cccnc2)cc1
MolPort-046-728-622	0.71	COc1cccc2[nH]cc(CCNC(=O)C=C)c12
MolPort-046-600-330	0.71	C=CC(=O)NCCc1c[nH]c2ccc(OCc3ccccc3)cc12
MolPort-023-199-781	0.71	CN(C)C(CNC(=O)\C=C\c1ccccc1)c1cn(C)c2ccccc12
MolPort-044-386-405	0.71	CC(=Cc1ccc(F)cc1)C(=O)NCCc1cccnc1
MolPort-044-207-454	0.71	O=C(NCCc1c[nH]c2ccccc12)C=Cc1ccco1
MolPort-044-283-615	0.71	Clc1cc(C=CC(=O)NCCc2c[nH]c3ccccc23)cc2OCCCOc12
MolPort-044-207-453	0.71	O=C(NCCc1c[nH]c2ccccc12)C=Cc1cccs1
MolPort-002-602-860	0.71	COc1ccc2[nH]cc(C(O)CN3CCN(C\C=C\c4ccccc4)CC3)c2c1
MolPort-009-110-057	0.71	O=C(NCCc1ccc(OCC#C)cc1)C=Cc1cccc2cccnc12
MolPort-044-283-615	0.71	Clc1cc(C=CC(=O)NCCc2c[nH]c3ccccc23)cc2OCCCOc12
MolPort-009-589-368	0.71	NC(=O)c1cccc(CCNC(=O)C=Cc2cccc3cccnc23)c1
MolPort-023-199-781	0.71	CN(C)C(CNC(=O)\C=C\c1ccccc1)c1cn(C)c2ccccc12
MolPort-044-386-405	0.71	CC(=Cc1ccc(F)cc1)C(=O)NCCc1cccnc1
MolPort-044-207-454	0.71	O=C(NCCc1c[nH]c2ccccc12)C=Cc1ccco1
MolPort-003-823-712	0.71	CN1C(=O)C(=C(C1=O)c1c[nH]c2ccccc12)c1c[nH]c2ccccc12
MolPort-000-705-749	0.71	CC(=O)N\C(=C\c1ccc(Cl)cc1)C(=O)NCCc1c[nH]c2ccccc12
MolPort-000-737-883	0.71	COc1ccc2[nH]cc(CCNC(C)=O)c2c1
MolPort-003-032-913	0.71	Cc1cc2cc(CCNC(=O)\C=C/c3ccccc3)c(=O)[nH]c2cc1C
MolPort-003-848-483	0.71	[2H]C([2H])(NC(C)=O)C([2H])([2H])c1c[nH]c2ccc(OC)cc12
MolPort-044-207-453	0.71	O=C(NCCc1c[nH]c2ccccc12)C=Cc1cccs1
MolPort-046-728-622	0.71	COc1cccc2[nH]cc(CCNC(=O)C=C)c12
MCULE-1545228810	0.70	C1(OC)C=C2O[C@H](C3C=CC(OC)=CC=3)[C@@H](O)C(=O)C2=C(OC)C=1
MCULE-6826487644	0.70	C1(=O)C2C=CC=CC=2OC(C2C=CC(=CC=2)O)C1OC
MCULE-3159000697	0.70	C1(OC)C=C2O[C@@H]([C@@H](O)C(C2=C(O)C=1)=O)C1C=CC(O)=CC=1
MCULE-5733387532	0.70	C1(OC)C=C2O[C@H](C3C=CC(O)=CC=3)[C@@H](O)C(=O)C2=C(O)C=1C
MCULE-6234117773	0.70	C1=C(C=C2C(C([C@@H]([C@@H](C3=CC=C(C(O)=C3)O)O2)O[C@H]2[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O2)=O)=C1O)O
MCULE-2099491698	0.70	[Cl-].O[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]1O[C+]1CC2C(=CC(=CC=2OC1C1C=C(O)C(O)=CC=1)O)O
MCULE-4463093454	0.70	C12C(O)=CC(O)=CC=1O[C@H](C1C=CC=CC=1)[C@@H](O)C2=O
MCULE-3686223068	0.70	C1(O)C=C2O[C@@H](C3C=CC(O)=C(O)C=3)[C@H](O[C@H]3[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O3)C(=O)C2=C(O)C=1
MCULE-4241987649	0.70	C1(O)C=C2O[C@H](C3C=CC(O)=C(O)C=3)[C@H](O[C@H]3[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O3)C(=O)C2=C(O)C=1
MCULE-9182612724	0.70	C1(O)C=C2O[C@H](C3C=CC(O)=CC=3)[C@@H](O)C(=O)C2=CC=1
MCULE-4560358638	0.70	C1(O)C=C2O[C@H](C3C=CC=CC=3)[C@@H](O)C(=O)C2=C(O)C=1
MCULE-5559057559	0.70	C1(O)C=C2O[C@H]([C@@H](C(C2=CC=1)=O)O)C1C=CC(O)=CC=1
MCULE-2275149602	0.70	C1(O)C=C2O[C@@H](C3C=CC(O)=C(O)C=3)[C@@H](O[C@H]3[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O3)C(=O)C2=C(O)C=1
MCULE-4867181308	0.70	C1=C(C2=C(C=C1O)O[C@@H]([C@@H](O[C@H]1[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O1)C2=O)C1=CC=C(C(O)=C1)O)O
MolPort-044-243-020	0.70	CN(C)c1ccc(cc1)C(CNC(=O)C=Cc1cccc(c1)[N+]([O-])=O)c1c[nH]c2ccccc12
MolPort-001-535-170	0.70	COc1ccc(CCNC(=O)C(=C\c2c[nH]c3ccccc23)\C#N)cc1
MolPort-002-568-255	0.70	COc1cc(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)cc(CC=C)c1O
MolPort-002-567-222	0.70	O=C(NCCc1c[nH]c2ccccc12)C(=C/c1ccc(cc1)N1CCCCC1)\C#N
MolPort-002-967-549	0.70	O=C(NCCc1c[nH]c2ccccc12)C(=C\c1ccc(cc1)N1CCCCC1)\C#N
MolPort-044-243-020	0.70	CN(C)c1ccc(cc1)C(CNC(=O)C=Cc1cccc(c1)[N+]([O-])=O)c1c[nH]c2ccccc12
MolPort-044-261-587	0.70	CN(CCc1ccc(F)cc1)C(=O)C=Cc1cccc2cccnc12
MolPort-020-149-129	0.70	COc1ccccc1C(C)=CC(=O)N(C)CCc1ccncc1
MolPort-046-596-939	0.70	COc1cc(\C=C\C(=O)NC(Cc2c[nH]c3ccccc23)C(O)=O)ccc1O
MolPort-044-223-445	0.70	COc1ccc(C=CC(=O)NCCc2ccc(C)nc2)cc1O
MolPort-009-372-197	0.70	O=C(NCCc1c[nH]c2ccccc12)C1=Cc2ccccc2OC1
MolPort-003-033-423	0.70	Cc1ccc2cc(CCNC(=O)\C=C/c3ccccc3)c(=O)[nH]c2c1C
MolPort-002-589-778	0.70	COc1ccc2[nH]c(C)c(C(=O)CN3CCN(C\C=C\c4ccccc4)CC3)c2c1
MolPort-003-033-123	0.70	COc1ccc(\C=C/C(=O)NCCc2cc3ccc(C)cc3[nH]c2=O)cc1OC
MolPort-044-261-587	0.70	CN(CCc1ccc(F)cc1)C(=O)C=Cc1cccc2cccnc12
MolPort-002-630-267	0.70	Cc1ccc2[nH]cc(C(=O)CN3CCN(C\C=C\c4ccccc4)CC3)c2c1
MolPort-044-223-445	0.70	COc1ccc(C=CC(=O)NCCc2ccc(C)nc2)cc1O
MolPort-002-768-745	0.70	Cc1ccc2[nH]cc(CCNC(=O)\C=C\c3cnn(C)c3)c2c1
MolPort-002-969-925	0.70	CCOc1cc(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)ccc1OCC#C
MolPort-046-596-939	0.70	COc1cc(\C=C\C(=O)NC(Cc2c[nH]c3ccccc23)C(O)=O)ccc1O
MolPort-001-981-752	0.70	CCOc1cc(\C=C(\C#N)C(=O)NCCc2c[nH]c3ccccc23)ccc1OCC#C
MolPort-002-534-297	0.70	COc1cc(\C=C\C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(O)=O)ccc1O
MolPort-001-985-563	0.70	O=C(NCCc1c[nH]c2ccccc12)C(=C/C=C/c1ccccc1)\C#N
MolPort-002-888-203	0.70	[O-][N+](=O)c1ccc(Cl)c(C=CC(=O)NCCc2c[nH]c3ccccc23)c1
MolPort-001-005-607	0.70	O=C(NCCc1c[nH]c2ccccc12)C(=C\C=C\c1ccccc1)\C#N
MolPort-020-149-129	0.70	COc1ccccc1C(C)=CC(=O)N(C)CCc1ccncc1
MolPort-001-973-120	0.70	CC1=CC(=O)N(CCc2c[nH]c3ccc(OCc4ccccc4)cc23)C1=O
MolPort-001-736-391	0.70	CCC(=O)NCCc1c[nH]c2ccc(OC)cc12
MolPort-001-736-491	0.70	COc1ccc2[nH]cc(CCNC(=O)C(C)(C)C)c2c1
MolPort-000-855-468	0.70	COc1ccc2[nH]cc(CCNC(=O)C(C)C)c2c1
MCULE-1233872377	0.69	COC1=CC(OC)=C(C(COC(C2=CC=C(OCC3OCCC3)C=C2)=O)=O)C=C1
MCULE-8678602121	0.69	C1(O)=CC(O)=C2C(CC(C3C=CC(O)=C(O)C=3)OC2=C1)=O
MCULE-9899038190	0.69	OC1C=C2OC(C3C=CC(O)=C(O)C=3)CC(C2=CC=1)=O
MCULE-9583531134	0.69	C1(OC)C=C2O[C@H](C3C=CC4OCOC=4C=3)[C@H](O)CC2=C(OC)C=1
MCULE-1688833251	0.69	C1(O)C=C2O[C@H](C3C=C(O)C(O)=CC=3)CC(=O)C2=C(O)C=1
MCULE-3123185458	0.69	C1(C(=O)C2C=CC(=CC=2OCC2=CC=CC=C2)OC)C(O1)C1=CC=C2C(OCCCO2)=C1
MCULE-1604093945	0.69	C1(O)C=C2O[C@H](C3C(O)=CC(O)=CC=3)[C@@H](O)C(=O)C2=C(O)C=1
MCULE-6906830879	0.69	C1(O)C=C2O[C@H](C3C=C(O)C(O)=C(O)C=3)CC(=O)C2=CC=1
MCULE-4959289073	0.69	O1[C@H](C2=CC=CC=C2)[C@H](O)CC2C=CC(OC)=CC1=2
MCULE-1131774635	0.69	C1(O)C=C2O[C@H](C3C=CC(O)=C(O)C=3)CC(=O)C2=CC=1
MCULE-3225229511	0.69	C1(O)C(O)=CC([C@H]2OC3C=C(O)C=C(O)C=3C(=O)C2)=CC=1
MCULE-9385881266	0.69	C1(O)C=C2O[C@H](C3C=C(O)C4O[C@@H](C5C=C(OC)C(O)=CC=5)[C@H](CO)C=4C=3)[C@@H](O)C(=O)C2=C(O)C=1
MCULE-6923632463	0.69	C1(O)C=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(O)C=1O
MolPort-044-388-683	0.69	COC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C=Cc1ccccc1
MolPort-027-943-303	0.69	Cc1cccc2[nH]cc(C(=O)CN3CCC(=CC3)c3ccc(O)cc3)c12
MolPort-044-561-203	0.69	Oc1ccc2[nH]cc(CCNC(=O)c3ccc4ccccc4c3O)c2c1
MolPort-002-966-736	0.69	O=C(NCCc1c[nH]c2ccccc12)C(=C\c1ccc(cc1)N1CCOCC1)\C#N
MolPort-002-131-944	0.69	COc1ccc2[nH]cc(CCNC=O)c2c1
MolPort-044-388-683	0.69	COC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C=Cc1ccccc1
MolPort-027-943-303	0.69	Cc1cccc2[nH]cc(C(=O)CN3CCC(=CC3)c3ccc(O)cc3)c12
MolPort-010-903-032	0.69	CCCn1cc(CCNC(=O)\C=C\c2ccccc2)c2cccnc12
MolPort-044-561-203	0.69	Oc1ccc2[nH]cc(CCNC(=O)c3ccc4ccccc4c3O)c2c1
MolPort-010-313-454	0.69	CC(C)=CC(=O)NCC(c1c[nH]c2ccccc12)c1ccccc1Cl
MolPort-006-755-227	0.69	O=C(N1CCN(C\C=C\c2ccccc2)CC1)C(=O)c1c[nH]c2ccccc12
MolPort-002-647-338	0.69	Cc1ccc2[nH]cc(CCNC(=O)\C=C\c3ccco3)c2c1
MolPort-003-032-917	0.69	COc1ccc(\C=C/C(=O)NCCc2cc3cc(C)c(C)cc3[nH]c2=O)cc1OC
MolPort-044-211-548	0.69	CC(C)Oc1ccc(CCNC(=O)C=Cc2cccnc2)cc1
MolPort-001-664-778	0.69	COc1ccc2[nH]cc(CCNC(=O)CCl)c2c1
MolPort-044-211-548	0.69	CC(C)Oc1ccc(CCNC(=O)C=Cc2cccnc2)cc1
MolPort-003-183-401	0.69	COc1ccc(\C=C(/NC(=O)c2ccccc2)C(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-000-819-658	0.69	COc1ccc2[nH]c(C(O)=O)c(CCNC(=O)\C=C\c3ccc(O)c(OC)c3)c2c1
MolPort-004-662-391	0.69	CCc1cccc2c(c[nH]c12)C(=O)CN1CCC(=CC1)c1ccc(O)cc1
MolPort-007-874-526	0.69	COc1ccc2OCC(=Cc2c1)C(=O)NCCc1c[nH]c2ccc(OC)cc12
MolPort-002-513-015	0.69	COc1ccc(\C=C(\NC(=O)c2ccccc2)C(=O)NCCc2c[nH]c3ccccc23)cc1
MCULE-2703837005	0.68	C1(OC)C=C2OC(CC(C2=C(O)C=1)=O)C1C=CC(O)=C(O)C=1
MCULE-4928479927	0.68	C1(OC)C=C2O[C@H](C3C=C(O)C(O)=CC=3)CC(=O)C2=C(O)C=1
MCULE-8000658254	0.68	C1(O)C=C2O[C@H](C3C=C(O)C(OC)=C(OC)C=3)CC(=O)C2=C(O)C=1OC
MCULE-6286398411	0.68	C1(O)C=C2O[C@H](C3C=CC=CC=3O)[C@@H](O)C(=O)C2=C(O)C=1
MCULE-3714829206	0.68	C1(O)C=C2O[C@H](C3C(O)=CC=CC=3O)[C@@H](O)C(=O)C2=C(O)C=1
MCULE-2236290715	0.68	C12=C(O)C=C(O)C=C1O[C@H](CC2=O)C1=CC=C(OC)C(O)=C1
MCULE-9396529091	0.68	C1(O)C=C2OC(CC(=O)C2=C(O)C=1)C1C=CC(OC)=C(O)C=1
MCULE-4193299594	0.68	C1(O)C=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(O)C=1OC
MCULE-2028448851	0.68	C1(O)C=C2O[C@@H](CC(=O)C2=C(O)C=1)C1C=CC(OC)=C(O)C=1
MCULE-9044534531	0.68	C12C(O)=CC(O)=CC=1OC(CC2=O)C1C=CC(OC)=C(O)C=1
MCULE-3965785693	0.68	C1(C2=CC=C(OCC3=CC=CC=C3)C(OCC3=CC=CC=C3)=C2)OC2=C(C=CC=C2)C(=O)C1O
MCULE-8336811002	0.68	CC1C2C[C@](O)(C)[C@@H](C3C=CC(O)=C(O)C=3)OC=2C([C@@H]2C3C(=CC(O)=CC=3O)O[C@H](C3C=CC(O)=C(O)C=3)[C@H]2O)=C(O)C=1
MCULE-9575020223	0.68	C1(O)C(O)=C2O[C@H](C3C=CC(O)=C(O)C=3)CC(=O)C2=CC=1
MCULE-5463631459	0.68	C1(OC)C=C2O[C@H](C3C=CC(OC)=C(O)C=3)CC(=O)C2=C(O)C=1
MCULE-1890542536	0.68	C1(O)C2C(CC(C3C=C(O)C(OC)=CC=3)OC=2C=C(OC)C=1OC)=O
MCULE-6577549494	0.68	COC1C(O)=C(O)C=C(C(O[C@H]2[C@@H](C3=CC(O)=C(O)C(O)=C3)CC3=C(C(=CC(=C3)O)O)C2)=O)C=1
MCULE-7131810532	0.68	C12C(O)=CC(=CC=1O[C@@H](CC2=O)C1C=CC(=C(O)C=1)OC)O
MCULE-3924606015	0.68	C1(O)C=C2O[C@H](C3C=C(O)C=C(O)C=3)CC(=O)C2=C(O)C=1
MolPort-002-634-638	0.68	CC(N1CCN(C\C=C\c2ccccc2)CC1)C(=O)c1c[nH]c2ccccc12
MolPort-003-847-892	0.68	COc1cc2c(CCNC(C)=O)c[nH]c2cc1O
MolPort-046-762-795	0.68	[2H]C([2H])(NC(C)=O)C([2H])([2H])c1c[nH]c2cc(O)c(OC)cc12
MolPort-044-239-357	0.68	O=C(NCC(c1c[nH]c2ccccc12)c1ccccc1)C=Cc1cccs1
MolPort-002-973-522	0.68	CCC(C)n1cc(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)c2ccccc12
MolPort-002-533-932	0.68	Oc1ccc(CCNC(=O)Cc2c[nH]c3ccccc23)cc1
MolPort-003-033-317	0.68	Cc1ccc(C)c2[nH]c(=O)c(CCNC(=O)\C=C/c3ccccc3)cc12
MolPort-002-174-830	0.68	COc1ccc(\C=C(/NC(=O)c2ccc(OC)cc2)C(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-000-718-866	0.68	COc1ccc(\C=C(\NC(=O)c2ccc(OC)cc2)C(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-002-559-536	0.68	COc1ccc(cc1)C(=O)N\C(=C\c1cccc2ccccc12)C(=O)NCCc1c[nH]c2ccccc12
MolPort-002-947-563	0.68	Cc1ccc(COc2ccccc2\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-009-165-824	0.68	COc1cccc(C(CNC(=O)CCNC(=O)C=Cc2ccccc2)c2c[nH]c3ccccc23)c1OC
MolPort-003-033-167	0.68	COc1cc(\C=C/C(=O)NCCc2cc3ccc(C)cc3[nH]c2=O)cc(OC)c1OC
MolPort-003-033-428	0.68	COc1ccc(\C=C/C(=O)NCCc2cc3ccc(C)c(C)c3[nH]c2=O)cc1OC
MolPort-046-728-589	0.68	Cc1cccc2n(C)cc(CCNC(=O)C=C)c12
MolPort-044-258-220	0.68	O=C(NCCc1cccnc1)C=Cc1ccc2OCCc2c1
MolPort-044-292-609	0.68	O=C(NCCc1cccc2ccccc12)C=Cc1cccnc1
MolPort-002-332-768	0.68	COc1cccc(\C=C(\C#N)C(=O)NCCc2c[nH]c3ccccc23)c1OC(C)C
MolPort-002-337-628	0.68	COC(=O)COc1ccc(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)cc1OC
MolPort-003-032-959	0.68	COc1cc(\C=C/C(=O)NCCc2cc3cc(C)c(C)cc3[nH]c2=O)cc(OC)c1OC
MolPort-002-966-664	0.68	COc1cc(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)ccc1OCc1ccc(Cl)cc1
MolPort-044-292-609	0.68	O=C(NCCc1cccc2ccccc12)C=Cc1cccnc1
MolPort-044-258-220	0.68	O=C(NCCc1cccnc1)C=Cc1ccc2OCCc2c1
MolPort-046-728-589	0.68	Cc1cccc2n(C)cc(CCNC(=O)C=C)c12
MolPort-044-239-357	0.68	O=C(NCC(c1c[nH]c2ccccc12)c1ccccc1)C=Cc1cccs1
MolPort-046-762-795	0.68	[2H]C([2H])(NC(C)=O)C([2H])([2H])c1c[nH]c2cc(O)c(OC)cc12
MolPort-046-646-069	0.68	Cc1ccc2c(CCNC(=O)C=C)cn(C)c2c1
MolPort-044-388-663	0.68	COC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C=Cc1ccc(OC(F)F)cc1
MolPort-044-398-786	0.68	CN(C)c1ccc(cc1)C(CNC(=O)C=Cc1ccccc1[N+]([O-])=O)c1c[nH]c2ccccc12
MolPort-044-260-896	0.68	O=C(NCCc1ccccc1)C=Cc1cccnc1
MolPort-044-281-180	0.68	CC(CNC(=O)C=Cc1cccnc1)c1ccccc1
MolPort-044-272-267	0.68	CC(C)(CNC(=O)C=Cc1cccnc1)c1ccccc1
MolPort-006-441-145	0.68	COc1ccc(CN(CCc2c[nH]c3ccccc23)C(=O)CN(C2CC2)C(=O)\C=C\c2ccc(cc2)[N+]([O-])=O)cc1
MolPort-001-736-545	0.68	COc1ccc2[nH]cc(CCNC(=O)C(F)(F)F)c2c1
MolPort-000-849-682	0.68	COc1ccc2[nH]cc(CCNC(=O)Cc3ccccc3)c2c1
MolPort-044-260-896	0.68	O=C(NCCc1ccccc1)C=Cc1cccnc1
MolPort-000-697-688	0.68	COc1ccc(\C=C(/NC(=O)c2cccc(C)c2)C(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-044-272-267	0.68	CC(C)(CNC(=O)C=Cc1cccnc1)c1ccccc1
MolPort-044-281-180	0.68	CC(CNC(=O)C=Cc1cccnc1)c1ccccc1
MolPort-003-033-012	0.68	COc1ccc(OC)c2[nH]c(=O)c(CCNC(=O)\C=C/c3ccccc3)cc12
MolPort-001-741-837	0.68	Oc1ccc(CCNC(=O)\C=C\c2ccc(O)cc2)cc1
MolPort-044-398-786	0.68	CN(C)c1ccc(cc1)C(CNC(=O)C=Cc1ccccc1[N+]([O-])=O)c1c[nH]c2ccccc12
MolPort-003-002-604	0.68	Clc1ccc2[nH]cc(CCNC(=O)\C=C\c3ccco3)c2c1
MolPort-008-821-918	0.68	Brc1ccc2c(c[nH]c2c1)C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12
MolPort-002-769-045	0.68	Cn1cc(\C=C\C(=O)NCCc2c[nH]c3ccc(Cl)cc23)cn1
MolPort-002-559-838	0.68	CCOc1ccc(\C=C(\NC(=O)c2ccccc2)C(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-044-388-663	0.68	COC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C=Cc1ccc(OC(F)F)cc1
MolPort-007-564-138	0.68	COc1ccc(\C=C(\NC(=O)c2cccc(C)c2)C(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-046-646-069	0.68	Cc1ccc2c(CCNC(=O)C=C)cn(C)c2c1
MolPort-046-697-097	0.67	CCOc1ccccc1CCNC(=O)\C=C\c1c[nH]c2c(OC)cccc12
MolPort-044-209-541	0.67	COC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C=Cc1cccc(OC)c1
MolPort-044-207-322	0.67	Oc1ccc(CCNC(=O)C=Cc2ccccc2)cc1
MolPort-039-032-918	0.67	CN1C(=O)C(=C(C1=O)c1cn(C)c2ccccc12)c1c[nH]c2ccccc12
MolPort-002-174-778	0.67	O=C(NCCc1c[nH]c2ccccc12)C(\NC(=O)c1ccccc1)=C\c1cccc2ccccc12
MolPort-044-222-172	0.67	Cn1cc(C=CC(=O)NCCc2cccc(c2)C(N)=O)c2ccccc12
MolPort-009-595-343	0.67	COc1ccc(CC(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-002-967-552	0.67	CCOc1cc(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)ccc1OCC(=O)OC
MolPort-008-362-324	0.67	CC(C)CN(C\C=C\c1ccccc1)C(=O)Cc1cccnc1
MolPort-002-558-746	0.67	COc1ccc(cc1)C(=O)N\C(=C\c1ccc(Br)cc1)C(=O)NCCc1c[nH]c2ccccc12
MolPort-044-723-386	0.67	Fc1ccc2[nH]cc(C3=CC(=O)NC3=O)c2c1
MolPort-010-898-010	0.67	COCCn1cc2CCN(Cc3cccc1c23)C(=O)\C=C\c1ccccc1
MolPort-046-697-097	0.67	CCOc1ccccc1CCNC(=O)\C=C\c1c[nH]c2c(OC)cccc12
MolPort-005-671-255	0.67	COc1ccc(cc1)C(CNC(=O)CN1CCC(=CC1)c1ccc(O)cc1)c1c[nH]c2ccccc12
MolPort-003-033-324	0.67	COc1ccc(\C=C/C(=O)NCCc2cc3c(C)ccc(C)c3[nH]c2=O)cc1OC
MolPort-003-033-470	0.67	COc1cc(\C=C/C(=O)NCCc2cc3ccc(C)c(C)c3[nH]c2=O)cc(OC)c1OC
MolPort-003-941-462	0.67	COc1ccc2n(CCCN(C)C)cc(C3=C(C(=O)NC3=O)c3c[nH]c4ccccc34)c2c1
MolPort-006-385-373	0.67	[O-][N+](=O)c1ccccc1\C=C(/C#N)C(=O)NCCc1c[nH]c2ccccc12
MolPort-044-209-541	0.67	COC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C=Cc1cccc(OC)c1
MolPort-001-739-474	0.67	CC(=O)NCCc1c[nH]c2ccccc12
MolPort-039-032-918	0.67	CN1C(=O)C(=C(C1=O)c1cn(C)c2ccccc12)c1c[nH]c2ccccc12
MolPort-044-291-269	0.67	O=C(NCCc1c[nH]c2ccccc12)C=Cc1cnccn1
MolPort-002-570-197	0.67	Cc1[nH]c2ccccc2c1C(=O)CN1CCN(C\C=C\c2ccccc2)CC1
MolPort-008-440-151	0.67	Oc1ccc(CCNC(=O)\C=C\c2ccccc2)cc1
MolPort-044-207-322	0.67	Oc1ccc(CCNC(=O)C=Cc2ccccc2)cc1
MolPort-002-174-721	0.67	COc1ccc(cc1)C(=O)N\C(=C/c1ccc(Br)cc1)C(=O)NCCc1c[nH]c2ccccc12
MolPort-002-966-601	0.67	Fc1cc(\C=C(\C#N)C(=O)NCCc2c[nH]c3ccccc23)ccc1N1CCCC1
MolPort-002-622-460	0.67	Fc1ccc2[nH]cc(C(=O)CN3CCN(C\C=C\c4ccccc4)CC3)c2c1
MCULE-9660679251	0.67	C1(O)C=C2OC(CC(C2=C(O)C=1OC)=O)C1C=CC=CC=1
MCULE-7381526517	0.67	C1(O[C@H]2[C@H](O)[C@](CO)(O)CO2)C=C2O[C@H](C3C=CC(O)=C(O)C=3)[C@@H](O)CC2=C(O)C=1
MCULE-8583168504	0.67	C1(O)C=C2O[C@H](C3C=CC(OC)=C(O)C=3)CCC2=CC=1
MCULE-8632464766	0.67	[C@H]1(C2=CC=C3OC(C4=CC=CC=C4)(C4=CC=CC=C4)OC3=C2)OC2=CC(O)=CC(O)=C2C[C@@H]1O
MCULE-2155733657	0.67	COC1=C(C(COC(C2=CC=C(OCC3OCCC3)C=C2)=O)=O)C=CC=C1
MCULE-2316302341	0.67	C1(O)C=C2O[C@H](C3C=CC(O)=CC=3)[C@@H](O)[C@H](O)C2=CC=1
MCULE-3564308719	0.67	CCCCOC1=C(OCC)C=C(C(OC(C(C2=C(OC)C=C(OC)C=C2)=O)C)=O)C=C1
MCULE-9587381415	0.67	C1(O)C=C2O[C@H](C3C=C(OC)C(O)=CC=3)CC(=O)C2=C(O)C=1
MCULE-7830277688	0.67	C1(OC)C=C2O[C@H](C3C=C(O)C=C(O)C=3)CC(=O)C2=C(O)C=1
MCULE-5996392590	0.67	C1(O)C(OC2C(=C(O)C3=C(C=2)OC(C2C=CC(O)=CC=2)C23OC3C(C2=O)=C(O)C=C(O)C=3)C1)C1C=CC(O)=C(O)C=1
MCULE-7590247408	0.67	O[C@@H]1[C@@H](O)[C@H](O)[C@H](OC1C1C(O)=C2C(=O)[C@H](O)[C@@H](C3C=CC(O)=CC=3)OC2=CC=1O)CO
MCULE-3601358321	0.67	C1(O)C=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(O)C=1OC
MCULE-3324355674	0.67	C1(C=C2OC(CC(C2=C(O)C=1)=O)C1=CC=C(O)C(OC)=C1)O
MCULE-2805260891	0.67	C12(COC3=C(C=CC=C3)C1=O)C(O2)C1=CC=C(C=C1)C(C)C
MolPort-001-736-480	0.67	CCC(C)C(=O)NCCc1c[nH]c2ccc(OC)cc12
MolPort-044-222-172	0.67	Cn1cc(C=CC(=O)NCCc2cccc(c2)C(N)=O)c2ccccc12
MolPort-046-639-267	0.67	CC(CNC(=O)C=C)c1cccc2cccnc12
MolPort-002-888-053	0.67	COC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)\C=C\c1ccc(cc1)C(C)C
MolPort-002-946-626	0.67	Cc1[nH]c2ccccc2c1\C=C(/C#N)C(=O)NCCc1c[nH]c2ccccc12
MolPort-000-858-534	0.67	COc1ccc2[nH]cc(CCNC(=O)C(c3ccccc3)c3ccccc3)c2c1
MolPort-009-029-536	0.67	COc1ccc(cc1)C(CNC(C)=O)c1c[nH]c2ccccc12
MolPort-009-048-163	0.67	CCC=C(C)C(=O)NCCc1cccc2cccnc12
MolPort-001-887-817	0.67	O=C(NCCc1ccccc1)C(=C\c1c[nH]c2ccccc12)\C#N
MolPort-001-985-564	0.67	CCOc1cc(\C=C(\C#N)C(=O)NCCc2c[nH]c3ccccc23)ccc1OCC(=O)OC
MolPort-046-639-267	0.67	CC(CNC(=O)C=C)c1cccc2cccnc12
MolPort-001-736-518	0.67	CCCC(=O)NCCc1c[nH]c2ccc(OC)cc12
MolPort-044-291-269	0.67	O=C(NCCc1c[nH]c2ccccc12)C=Cc1cnccn1
MolPort-044-723-386	0.67	Fc1ccc2[nH]cc(C3=CC(=O)NC3=O)c2c1
MolPort-003-033-124	0.66	Cc1ccc2cc(CCNC(=O)\C=C/c3ccc4OCOc4c3)c(=O)[nH]c2c1
MolPort-020-035-876	0.66	COc1ccc(cc1OC)C(C)(C)CNC(=O)C=Cc1ccncc1
MolPort-002-563-551	0.66	Cc1ccc(cc1)C(=O)N\C(=C/c1ccc(Br)cc1)C(=O)NCCc1c[nH]c2ccccc12
MolPort-003-033-369	0.66	COc1cc(\C=C/C(=O)NCCc2cc3c(C)ccc(C)c3[nH]c2=O)cc(OC)c1OC
MolPort-002-561-087	0.66	COc1ccc2n(C)c(C)c(C(=O)CN3CCN(C\C=C\c4ccccc4)CC3)c2c1
MolPort-045-988-244	0.66	CCC(=C)C(=O)NCCc1cn(C)c2ccccc12
MolPort-039-032-374	0.66	Cn1ccc2cc(ccc12)C(O)CNC(=O)\C=C\c1ccccc1
MolPort-044-244-721	0.66	COc1ccc(CCNC(=O)C(=Cc2c[nH]c3ccccc23)C#N)cc1OC
MolPort-044-296-173	0.66	Clc1ccc(C=C(NC(=O)c2ccccc2)C(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-044-193-653	0.66	OCCN(CCc1c[nH]c2ccccc12)Cc1ccc(C=CC(=O)NO)cc1
MolPort-027-933-316	0.66	COc1ccc(cc1)C1=CCN(C1)C(=O)Cn1cc(C)c2ccccc12
MolPort-044-243-035	0.66	CN(C)c1ccc(cc1)C(CNC(=O)C=Cc1ccco1)c1c[nH]c2ccccc12
MolPort-027-933-311	0.66	COc1ccc(cc1)C1=CCN(C1)C(=O)CCn1ccc2ccccc12
MolPort-020-035-730	0.66	COc1ccc(cc1OC)C(C)(C)CNC(=O)C=Cc1cccnc1
MolPort-044-399-671	0.66	Brc1ccc2[nH]cc(C=C(C#N)C(=O)NCCc3ccccc3)c2c1
MolPort-044-561-731	0.66	Cn1cc(C2=C(C(=O)NC2=O)c2cccc(N)c2)c2ccccc12
MolPort-044-210-922	0.66	O=C(NCCc1ccccc1)C=Cc1ccncc1
MolPort-044-210-255	0.66	CC(CNC(=O)C=Cc1ccncc1)c1ccccc1
MolPort-044-209-557	0.66	COC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C=Cc1ccc(OC)c(OC)c1
MolPort-002-470-789	0.66	COc1ccc(cc1)C(CNC(=O)CCl)c1c[nH]c2ccccc12
MolPort-007-874-528	0.66	COc1ccc2OCC(=Cc2c1)C(=O)NCCc1c[nH]c2ccc(C)cc12
MolPort-045-988-244	0.66	CCC(=C)C(=O)NCCc1cn(C)c2ccccc12
MolPort-039-032-374	0.66	Cn1ccc2cc(ccc12)C(O)CNC(=O)\C=C\c1ccccc1
MolPort-002-967-290	0.66	CCOc1cc(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)cc(Cl)c1OCC#C
MolPort-044-399-671	0.66	Brc1ccc2[nH]cc(C=C(C#N)C(=O)NCCc3ccccc3)c2c1
MolPort-027-933-311	0.66	COc1ccc(cc1)C1=CCN(C1)C(=O)CCn1ccc2ccccc12
MolPort-001-736-468	0.66	COc1ccc2[nH]cc(CCNC(=O)Cc3ccc(Br)cc3)c2c1
MolPort-004-896-879	0.66	COc1ccc(cc1)C(CNC(=O)C(C)C)c1c[nH]c2ccccc12
MolPort-009-505-520	0.66	COc1ccc(cc1)C(CNC(=O)C(C)(C)C)c1c[nH]c2ccccc12
MolPort-009-029-537	0.66	CCC(=O)NCC(c1c[nH]c2ccccc12)c1ccc(OC)cc1
MolPort-000-511-301	0.66	CCC(=O)NCCc1c[nH]c2cc(OC)ccc12
MolPort-000-515-965	0.66	COc1ccc2c(CCNC(=O)C(C)C)c[nH]c2c1
MolPort-006-441-173	0.66	CCCCN(CC(=O)N(CCc1c[nH]c2ccccc12)Cc1ccc(OC)cc1)C(=O)\C=C\c1ccc(cc1)[N+]([O-])=O
MolPort-002-046-150	0.66	CCOC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)\C=C\c1ccccc1
MolPort-001-985-579	0.66	COc1cc(\C=C(\C#N)C(=O)NCCc2c[nH]c3ccccc23)ccc1OCc1ccccc1F
MolPort-002-966-702	0.66	COc1cc(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)ccc1OCc1ccccc1F
MolPort-002-589-246	0.66	Cc1ccc(\C=C(\NC(=O)c2ccc(C)cc2)C(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-044-243-035	0.66	CN(C)c1ccc(cc1)C(CNC(=O)C=Cc1ccco1)c1c[nH]c2ccccc12
MolPort-027-933-316	0.66	COc1ccc(cc1)C1=CCN(C1)C(=O)Cn1cc(C)c2ccccc12
MolPort-020-035-876	0.66	COc1ccc(cc1OC)C(C)(C)CNC(=O)C=Cc1ccncc1
MolPort-009-608-416	0.66	COc1ccc2cc(ccc2c1)C(C)C(=O)NCCc1c[nH]c2ccccc12
MolPort-006-191-842	0.66	COc1ccc2[nH]cc(CCNC(=O)CN3CCNCC3)c2c1
MolPort-044-561-731	0.66	Cn1cc(C2=C(C(=O)NC2=O)c2cccc(N)c2)c2ccccc12
MolPort-020-035-730	0.66	COc1ccc(cc1OC)C(C)(C)CNC(=O)C=Cc1cccnc1
MolPort-007-874-686	0.66	Brc1ccc2OCC(=Cc2c1)C(=O)NCCc1c[nH]c2ccccc12
MolPort-044-209-557	0.66	COC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C=Cc1ccc(OC)c(OC)c1
MolPort-001-736-397	0.66	CC(=O)NCCc1c[nH]c2ccc(OCc3ccccc3)cc12
MolPort-044-244-721	0.66	COc1ccc(CCNC(=O)C(=Cc2c[nH]c3ccccc23)C#N)cc1OC
MolPort-010-898-005	0.66	COCCn1cc2CCN(Cc3cccc1c23)C(=O)\C=C\c1ccc(C)cc1
MolPort-044-296-173	0.66	Clc1ccc(C=C(NC(=O)c2ccccc2)C(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-002-215-067	0.66	Cc1ccc(\C=C(\NC(=O)c2cccc(C)c2)C(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-044-210-255	0.66	CC(CNC(=O)C=Cc1ccncc1)c1ccccc1
MolPort-002-966-577	0.66	Clc1cc2OCOc2cc1\C=C(/C#N)C(=O)NCCc1c[nH]c2ccccc12
MolPort-002-966-710	0.66	OC(=O)c1ccc(COc2ccc(\C=C(\C#N)C(=O)NCCc3c[nH]c4ccccc34)cc2I)cc1
MolPort-002-174-823	0.66	Clc1ccc(\C=C(/NC(=O)c2ccccc2)C(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-002-337-635	0.66	CCOc1cc(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)cc(Cl)c1OC(C)CC
MolPort-002-332-740	0.66	Cc1cccc(Cn2cc(\C=C(/C#N)C(=O)NCCc3c[nH]c4ccccc34)c3ccccc23)c1
MolPort-008-343-742	0.66	COc1cccc2c(\C=C(/C#N)C(=O)NCCc3ccccc3)c[nH]c12
MolPort-009-679-401	0.66	OCCN(CCc1c[nH]c2ccccc12)Cc1ccc(\C=C\C(=O)NO)cc1
MolPort-044-193-653	0.66	OCCN(CCc1c[nH]c2ccccc12)Cc1ccc(C=CC(=O)NO)cc1
MolPort-001-736-388	0.66	COc1ccc2[nH]cc(CCNC(=O)C3CC3)c2c1
MolPort-001-736-410	0.66	COc1ccc2[nH]cc(CCNC(=O)Cc3c[nH]c4ccccc34)c2c1
MolPort-044-210-922	0.66	O=C(NCCc1ccccc1)C=Cc1ccncc1
MolPort-007-561-836	0.66	CC(=O)N\C(=C\c1ccccc1)C(=O)NC(Cc1c[nH]c2ccccc12)C=O
MCULE-1627385258	0.66	COC1=CC(OC)=C(C(COC(COC2=CC=C(OCC3=CC=CC=C3)C=C2)=O)=O)C=C1
MCULE-8487893667	0.66	C1(O)C=C2OC[C@](O)(CC3C=CC(O)=C(O)C=3)[C@@H](O)C2=CC=1
MCULE-3220376293	0.66	C1(OCC2C=CC=CC=2)C=C(OC)C=CC=1CC(OC)C(O)C1=CC=CC=C1
MCULE-2408391183	0.66	C1(C(=O)C2C=CC=CC=2OCC2=CC=CC=C2)C(O1)C1C=CC2=C(OCCCO2)C=1
MCULE-4896354395	0.66	COC1=CC(OC)=C(C(COC(C2=CC3=C(OCCO3)C=C2)=O)=O)C=C1
MCULE-9557247198	0.66	C1(O)C=C2OC[C@](O)(CC3C=CC(O)=C(O)C=3)[C@H](OC)C2=CC=1
MCULE-1518526020	0.66	C1(C(=O)C2C=CC3=C(OCCO3)C=2)C(O1)C1C=C(OC)C(=C(OC)C=1)OC
MCULE-2108662486	0.66	C12OC3C(C)(C)C3C1=C1OC(C3C=CC=CC=3)CC(C1=C(OC)C=2)=O
MCULE-7688686969	0.66	C1(O)C=C2OC[C@](O)(CC3C=CC(O)=C(O)C=3)[C@@H](OC)C2=CC=1
MCULE-4287681592	0.66	C1(C=C2O[C@@H](C3C=CC(=CC=3)O)[C@H](C3C(O)=CC(O)=C4C(=O)[C@@H](O)[C@H](C5C=CC(O)=CC=5)OC=34)C(C2=C(O)C=1)=O)O
MCULE-7223978690	0.66	COC1=CC=C(C(C(OC(C2=CC=C(OCC3OCCC3)C=C2)=O)C)=O)C=C1
MCULE-2232530891	0.66	C1(OC)C=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(O)C=1OC
MCULE-9480249121	0.66	C12C=C(OC)C=CC=1OC(CC2=O)C1C=CC2=C(OCCO2)C=1
MCULE-7586369120	0.66	C12=C(CCC(C3=CC=CC=C3)O1)C=C(C=O)C(O)=C2C
MCULE-5242974703	0.66	C1(OC)C(CC(O)C(O)(C)C)=C2OC(C3C=CC=CC=3)CC(=O)C2=C(OC)C=1
MolPort-008-340-963	0.65	Clc1ccc2c(\C=C(/C#N)C(=O)NCCc3ccccc3)c[nH]c2c1
MolPort-002-714-943	0.65	COc1ccc(\C=C(/NC(=O)c2ccccc2)C(=O)NCCc2c(C)[nH]c3ccccc23)cc1
MolPort-001-736-392	0.65	Oc1ccc2[nH]cc(CCNC(=O)c3ccc(Cl)cc3)c2c1
MolPort-002-966-735	0.65	OC(=O)c1cccc(COc2ccccc2\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)c1
MolPort-002-556-762	0.65	CN(C)c1ccc(\C=C(\NC(=O)c2ccccc2)C(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-003-033-019	0.65	COc1ccc(\C=C/C(=O)NCCc2cc3c(OC)ccc(OC)c3[nH]c2=O)cc1OC
MolPort-002-174-795	0.65	CN(C)c1ccc(\C=C(/NC(=O)c2ccccc2)C(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-009-759-276	0.65	COc1ccc2[nH]cc(\C=C3\CC(=O)N(CCc4ccccc4)C3=O)c2c1
MolPort-004-964-764	0.65	COc1cc2c(CCNC(C)=O)c[nH]c2cc1Cl
MolPort-001-736-420	0.65	COc1ccc2[nH]cc(CCNC(=O)C(C)c3ccc(CC(C)C)cc3)c2c1
MolPort-002-318-504	0.65	CC[NH+](CC)CCc1c[nH]c2ccc(OC)cc12
MolPort-023-199-794	0.65	CN(C)C(CNC(=O)\C=C\c1ccc2OCOc2c1)c1cn(C)c2ccccc12
MolPort-000-709-338	0.65	COc1ccc(\C=C(\NC(=O)c2ccccc2)C(=O)NCCc2c[nH]c3ccccc23)cc1OC
MolPort-002-571-297	0.65	Cc1[nH]c2cc(C)ccc2c1C(=O)CN1CCN(C\C=C\c2ccccc2)CC1
MolPort-005-656-859	0.65	Oc1cc2ccccc2cc1C(=O)NCCc1c[nH]c2ccccc12
MolPort-008-440-319	0.65	Oc1ccccc1C(=O)NCCc1c[nH]c2ccccc12
MolPort-000-859-766	0.65	COc1ccc(CCNC(=O)Cc2c[nH]c3ccccc23)cc1
MolPort-008-344-139	0.65	O=C(NCCc1ccccc1)C(=C\c1ccc2[nH]ccc2c1)\C#N
MolPort-001-736-399	0.65	COc1ccc2[nH]cc(CCNC(=O)CCCl)c2c1
MolPort-001-736-394	0.65	COc1ccc2[nH]cc(CCNC(=O)c3ccccc3)c2c1
MolPort-044-181-783	0.65	COc1ccc2[nH]cc(CCNC(=O)c3ccc4ncccc4c3)c2c1
MolPort-008-336-352	0.65	O=C(NCCc1ccccc1)C(=C\c1cccc2[nH]ccc12)\C#N
MolPort-002-174-637	0.65	COc1ccccc1\C=C(/NC(=O)c1ccccc1)C(=O)NCCc1c[nH]c2ccccc12
MolPort-008-323-607	0.65	COc1ccccc1\C=C(\NC(=O)c1ccccc1)C(=O)NCCc1c[nH]c2ccccc12
MolPort-002-087-423	0.65	CC(C)C(=O)NCCc1c[nH]c2ccccc12
MolPort-002-698-137	0.65	CC(C)(C)C(=O)NCCc1c[nH]c2ccccc12
MolPort-000-717-177	0.65	CCC(=O)NCCc1c[nH]c2ccccc12
MolPort-005-817-791	0.65	O=C(Cc1c[nH]c2ccccc12)N1CCC(=CC1)c1ccccc1
MolPort-020-220-416	0.65	C\C(CN1CC(C1)c1cccnc1)=C/c1ccccc1
MolPort-004-612-095	0.65	C=CCNC(=O)Cc1c[nH]c2ccccc12
MolPort-001-973-135	0.65	COc1ccc2[nH]cc(CCNC(N)=O)c2c1
MolPort-002-973-286	0.65	Cc1cc(ccc1\C=C(/C#N)C(=O)NCCc1c[nH]c2ccccc12)N1CCOCC1
MolPort-002-562-796	0.65	Brc1cc2OCOc2cc1\C=C(/C#N)C(=O)NCCc1c[nH]c2ccccc12
MolPort-002-967-292	0.65	COc1cc(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)ccc1OCc1ccccc1C#N
MolPort-001-736-120	0.65	NC1=C(C(=O)NC1=O)c1c[nH]c2ccccc12
MolPort-001-958-248	0.65	COc1ccc(\C=C(/NC(=O)c2ccccc2)C(=O)NCCc2c[nH]c3ccccc23)cc1OC
MolPort-006-391-896	0.65	CC(=O)NCCc1c[nH]c2ccc(N)cc12
MolPort-000-152-695	0.65	ClCC(=O)NCCc1c[nH]c2ccccc12
MolPort-002-716-896	0.65	COc1ccc2[nH]cc(CCNC(C)C)c2c1
MolPort-007-489-315	0.65	Clc1ccc2OCC(=Cc2c1)C(=O)NCCc1cccc2cccnc12
MolPort-044-409-387	0.65	O=C(NCCc1ccc2OCCOc2c1)C=Cc1cccc2cccnc12
MolPort-035-944-987	0.65	COc1ccc2[nH]cc(CC(=O)NC3CC3)c2c1
MolPort-046-728-808	0.65	CC(Cc1cn(C)c2ccccc12)NC(=O)C=C
MolPort-028-270-495	0.65	COc1ccc2[nH]cc(CCNC(=O)CSC)c2c1
MolPort-044-271-230	0.65	Cc1cccc(C=CC(=O)NC(Cc2c[nH]c3cc(F)ccc23)C(O)=O)c1
MolPort-006-385-378	0.65	[O-][N+](=O)c1cc(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)ccc1Cl
MolPort-002-614-145	0.65	COc1ccc2[nH]cc(C(=O)CN3CCC(=CC3)c3ccc(F)cc3)c2c1
MolPort-003-032-918	0.65	Cc1cc2cc(CCNC(=O)\C=C/c3ccc4OCOc4c3)c(=O)[nH]c2cc1C
MolPort-000-784-789	0.65	CC(C)(C)c1ccc(cc1)C(=O)N\C(=C/c1ccc(Br)cc1)C(=O)NCCc1c[nH]c2ccccc12
MolPort-046-701-461	0.65	Oc1ccc(C=CC(=O)NCCc2ccc(O)c(O)c2)cc1
MolPort-027-836-935	0.65	Oc1ccc(\C=C\C(=O)NCCc2ccc(O)c(O)c2)cc1
MolPort-001-741-307	0.65	Oc1ccc(CCNC(=O)\C=C\c2ccc(O)c(O)c2)cc1
MolPort-002-951-849	0.65	CCOC(=O)COc1ccccc1\C=C(/C#N)C(=O)NCCc1c[nH]c2ccccc12
MolPort-002-332-702	0.65	COc1cc(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)cc(Br)c1OCC=C
MolPort-002-966-731	0.65	CCOc1cc(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)c(Br)c(Br)c1O
MCULE-6254841864	0.65	C1(O[C@H]2[C@H](O)[C@@H](O)[C@@H](O2)CO)C=C2O[C@H](C3C=CC(O)=C(O)C=3)[C@@H](O)CC2=C(O)C=1
MolPort-003-941-663	0.65	OC(=O)C(O)=O.CNCCc1c[nH]c2ccc(O)cc12
MCULE-3316368164	0.65	C12C=C(C)C=CC=1OC(CC2=O)C1=CC=C2C(OCCO2)=C1
MolPort-027-896-088	0.65	COc1ccc2[nH]cc(CCNC(=O)c3ccc4[nH]ccc4c3)c2c1
MCULE-4597198409	0.65	OC1C(O)C(O)C(OC1C1C(=C2C(=O)CC(C3C=CC(O)=CC=3)OC2=CC=1O)O)CO
MolPort-023-199-794	0.65	CN(C)C(CNC(=O)\C=C\c1ccc2OCOc2c1)c1cn(C)c2ccccc12
MCULE-6592133711	0.65	CC1C(O)C(O)C(O)C(OC2C(=O)C3C(=CC(=CC=3O)O)OC2C2C=CC(O)=CC=2)O1
MolPort-046-728-808	0.65	CC(Cc1cn(C)c2ccccc12)NC(=O)C=C
MCULE-4193314774	0.65	OC1=C2C(C[C@@H](C3C=CC=CC=3)OC2=C(OC)C(OC)=C1)=O
MolPort-020-220-416	0.65	C\C(CN1CC(C1)c1cccnc1)=C/c1ccccc1
MCULE-3426201479	0.65	C12C=C(C=CC(=O)C=1C=CC=C2[C@@H]1[C@H](O)CC2C(O)=CC(O)=CC=2O1)[C@@H]1[C@H](O)CC2C(O)=CC(O)=CC=2O1
MolPort-044-181-783	0.65	COc1ccc2[nH]cc(CCNC(=O)c3ccc4ncccc4c3)c2c1
MCULE-9921589051	0.65	O=C(C1=CC2=C(CCC2)C=C1)COC(C1=CC=C(OCC2OCCC2)C=C1)=O
MolPort-027-836-935	0.65	Oc1ccc(\C=C\C(=O)NCCc2ccc(O)c(O)c2)cc1
MCULE-9527875629	0.65	C1=C(O)C2=C(O[C@@H]([C@H](C2=O)O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)C2=CC=C(O)C=C2)C=C1O
MolPort-046-701-461	0.65	Oc1ccc(C=CC(=O)NCCc2ccc(O)c(O)c2)cc1
MCULE-1778800371	0.65	[C@@H]1(OC2=C(C(O)=CC(O)=C2)C(=O)[C@]1([H])O[C@@H]1O[C@H]([C@H](O)[C@@H](O)[C@H]1O)C)C1=CC=C(O)C=C1
MolPort-044-271-230	0.65	Cc1cccc(C=CC(=O)NC(Cc2c[nH]c3cc(F)ccc23)C(O)=O)c1
MCULE-7943994885	0.65	C1(O)C=C2O[C@H](C3C=CC(O)=CC=3)[C@@H](O[C@H]3[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O3)C(=O)C2=C(O)C=1
MolPort-028-270-495	0.65	COc1ccc2[nH]cc(CCNC(=O)CSC)c2c1
MCULE-6030144398	0.65	O[C@@H]1[C@@H](O)[C@H](O)[C@H](O[C@H]1C1C(=C2C(=O)C[C@@H](C3C=CC(O)=CC=3)OC2=CC=1O)O)CO
MolPort-027-896-088	0.65	COc1ccc2[nH]cc(CCNC(=O)c3ccc4[nH]ccc4c3)c2c1
MCULE-9298140592	0.65	O1C2C=CC=CC=2C(C[C@]1([H])C1=CC=C2C(OCCO2)=C1)=O
MolPort-035-944-987	0.65	COc1ccc2[nH]cc(CC(=O)NC3CC3)c2c1
MCULE-1920414499	0.65	C1(C(O)=O)=CC2=C(OC(CC2)(C)C)C(O)=C1O
MolPort-044-409-387	0.65	O=C(NCCc1ccc2OCCOc2c1)C=Cc1cccc2cccnc12
MCULE-8978551782	0.65	COC1=CC(C2OC3C=C(OC)C=CC=3C(=O)C2)=CC(OC)=C1OC
MCULE-4692826561	0.65	C1(C(=O)C2C=C(F)C=CC=2OCC2C=CC=CC=2)C(O1)C1=CC=C2C(OCCO2)=C1
MCULE-8847685016	0.65	COC1C=C(O)C(OC)=C2C=1C(CC(C1C=CC=CC=1)O2)=O
MCULE-6625145109	0.65	C1(C(OCC)=O)OC2=CC(OCC3=CC=CC=C3)=CC=C2CC1
MCULE-9330611865	0.65	C1(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)CO2)C=C2O[C@H](C3C=CC(O)=C(O)C=3)[C@@H](O)CC2=C(O)C=1
MCULE-3458953916	0.65	O1C2C=CC=CC=2C[C@@H](O)[C@@H]1C1C=CC=CC=1
MCULE-9602960797	0.65	C1(O)C(OC)=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(OC)C=1
MCULE-6930739422	0.65	C12C(O)=CC(=CC=1O[C@@H]([C@@H](O)C2=O)C1=CC=C(C=C1)O)OC/C=C(\C)/C
MCULE-9660563348	0.65	C12C=CC(OC)=CC=1OC(CC2=O)C1C=CC(OC)=C(OC)C=1
MCULE-8468757536	0.65	O(C1C=C2O[C@H](C3C=CC(O)=C(O)C=3)[C@@H](O)CC2=C(O)C=1)C1C(O)C(C(CO1)O)O
MolPort-009-585-005	0.64	CCC(=O)NCCc1c[nH]c2cc(C)ccc12
MolPort-020-135-316	0.64	Cc1ccc2c(CCNC(=O)C(C)(C)C)c[nH]c2c1
MolPort-004-885-095	0.64	CC(C)(C(=O)NCCc1c[nH]c2ccccc12)c1ccccc1
MolPort-007-945-634	0.64	O=C(Cc1cccc2ccccc12)NCCc1c[nH]c2ccccc12
MolPort-009-252-424	0.64	Cc1cccc(C(=O)NCCc2c[nH]c3ccccc23)c1O
MolPort-020-135-316	0.64	Cc1ccc2c(CCNC(=O)C(C)(C)C)c[nH]c2c1
MolPort-035-945-076	0.64	CCOc1ccc2[nH]cc(CC(=O)NC(C)C)c2c1
MolPort-042-676-096	0.64	Cc1[nH]c2ccccc2c1CCNCc1ccc(C=CC(=O)NO)cc1
MolPort-045-926-754	0.64	COc1ccc2[nH]cc(CCNC(=O)CCCN3CCCC3=O)c2c1
MolPort-044-239-457	0.64	Clc1ccccc1C(CNC(=O)C=Cc1cccs1)c1c[nH]c2ccccc12
MolPort-045-968-956	0.64	O=C(NC1CCCN(CCc2ccccc2)C1)\C=C\c1c[nH]c2ccccc12
MolPort-044-207-615	0.64	Clc1ccc(C=CC(=O)NCCc2c[nH]c3ccccc23)s1
MolPort-042-693-220	0.64	CC(=O)NCC(c1c[nH]c2ccccc12)c1ccccc1
MolPort-028-611-167	0.64	Cn1cc(C(O)CNC(=O)\C=C\c2cccs2)c2ccccc12
MolPort-046-600-331	0.64	ClCC(=O)NCCc1c[nH]c2ccc(OCc3ccccc3)cc12
MCULE-9560944092	0.64	O[C@@H]1[C@@H](C2C(O)=CC(O)=C3C[C@H]([C@H](OC=23)C2C=C(O)C(O)=CC=2)O)C2C(=C3[C@@]4([C@@H](O)[C@](OC5C4=C(O)C=C(O)C=5)(C4C=C(O)C(O)=CC=4)OC3=CC=2O)[H])O[C@@H]1C1C=C(O)C(O)=CC=1
MolPort-046-452-512	0.64	Oc1ccc(C=CC(=O)NCCc2ccccc2)cc1O
MCULE-6010310511	0.64	C1(O)C=C2O[C@]3(OC4C(=C5O[C@H](C6C=CC(O)=C(O)C=6)[C@@H](O)CC5=C(O)C=4)[C@H]([C@@H]3O)C2=C(O)C=1)C1C=CC(O)=C(O)C=1
MolPort-044-296-799	0.64	Fc1ccc(C=C(NC(=O)c2ccccc2)C(=O)NCCc2c[nH]c3ccccc23)cc1
MCULE-2527326110	0.64	C1(O)C=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(O)C=1
MolPort-045-946-928	0.64	COc1ccc2[nH]cc(CCNC(=O)C3CC3(C)C)c2c1
MCULE-3360689877	0.64	C1(O)C=C2O[C@]3(OC4C(=C5O[C@H](C6C=CC(O)=C(O)C=6)[C@H](O)CC5=C(O)C=4)[C@H]([C@@H]3O)C2=C(O)C=1)C1C=CC(O)=C(O)C=1
MolPort-044-394-124	0.64	COc1ccc(CCNC(=O)C=Cc2ccc3ccccc3n2)cc1OC
MCULE-3958961905	0.64	C1(O[C@H]2[C@H](O[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@@H](CO)O2)C=C2O[C@H](C3C=CC(OC)=C(O)C=3)[C@@H](O)C(=O)C2=C(O)C=1
MolPort-044-211-422	0.64	Fc1ccc(CCNC(=O)C=Cc2cccnc2)cc1
MCULE-2295691776	0.64	[C@@H]1([C@H](O)C(C2C=CC=CC=2O1)=O)C1C=CC=CC=1
MolPort-044-254-029	0.64	COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C=Cc1ccc(cc1)C(=O)OC
MCULE-5852778653	0.64	C12C(O)=CC(=CC=1O[C@H](CC2=O)C1C=CC(=CC=1)O)O
MolPort-000-738-549	0.64	Brc1cccc(c1)C(=O)N\C(=C\c1cccc2ccccc12)C(=O)NCCc1c[nH]c2ccccc12
MCULE-4545247441	0.64	C12C3=CC(OC)=CC=C3OC3(CCCCC3)C1O2
MolPort-002-100-160	0.64	CC(C)C(=O)NCCc1c[nH]c2ccc(C)cc12
MCULE-7997155475	0.64	C1(O)C=C2O[C@H](C3C=C(C/C=C(\C)/C)C(O)=C(C/C=C(\C)/C)C=3)[C@@H](O)C(=O)C2=C(O)C=1
MolPort-042-693-220	0.64	CC(=O)NCC(c1c[nH]c2ccccc12)c1ccccc1
MCULE-8154919951	0.64	C1(OC)C=C2O[C@H](C3C=CC(OC)=C(OC)C=3)CCC2=CC=1
MolPort-005-933-338	0.64	Cc1[nH]c2ccccc2c1CCNCc1ccc(\C=C\C(=O)NO)cc1
MCULE-9922758733	0.64	C1(O)C(OC)=C2O[C@H](C3C=CC=CC=3O)CC(=O)C2=C(O)C=1
MolPort-002-337-638	0.64	Oc1ccc(cc1)-n1cccc1\C=C(/C#N)C(=O)NCCc1c[nH]c2ccccc12
MCULE-3254872691	0.64	C12C(O)=CC(=CC=1O[C@H](CC2=O)C1C=CC(=CC=1)O)O
MolPort-002-558-303	0.64	Clc1ccccc1C(=O)N\C(=C\c1ccc(Br)cc1)C(=O)NCCc1c[nH]c2ccccc12
MCULE-7028658249	0.64	C1(C=C2O[C@@H](C3C=CC(=CC=3)O)[C@H](C3C(O)=CC(O)=C4C(=O)C[C@H](C5C=CC(O)=CC=5)OC=34)C(C2=C(O)C=1)=O)O
MolPort-045-926-754	0.64	COc1ccc2[nH]cc(CCNC(=O)CCCN3CCCC3=O)c2c1
MCULE-5742809714	0.64	C1(OC)C(OC)=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(OC)C=1O
MolPort-016-622-891	0.64	CC(=O)NCC1=CCCN(CCc2c[nH]c3ccccc23)C1
MCULE-6777649457	0.64	C12C=C(C)C=CC=1C(=O)CC(C1C=CC3=C(OCCO3)C=1)O2
MolPort-001-736-451	0.64	COc1ccc2[nH]cc(CCNC(=O)c3ccc(cc3)C(C)(C)C)c2c1
MCULE-1539908631	0.64	C1(O)C(C/C=C(\C)/C)=C2O[C@H](C3C=CC=CC=3)[C@@H](O)C(=O)C2=C(O)C=1
MolPort-002-039-733	0.64	CC(Cl)C(=O)NCCc1c[nH]c2ccccc12
MCULE-6530426654	0.64	C12C(O)=C(OC)C(OC3C(OC(=O)C4C(O)=C(OC)C(=CC=43)O)C)=CC=1C(O)C(C)OC2=O
MolPort-002-966-722	0.64	[O-][N+](=O)c1ccc(Cl)c(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)c1
MCULE-5817407631	0.64	C1(O)C([C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(O)C=1
MolPort-002-586-391	0.64	CN(C)c1ccc(\C=C(\NC(=O)c2ccc(C)cc2)C(=O)NCCc2c[nH]c3ccccc23)cc1
MCULE-9154486801	0.64	C1(C(=O)C2C=CC=CC=2OCC2=CC=CC=C2)C(O1)C1=CC=CC=C1
MolPort-044-239-457	0.64	Clc1ccccc1C(CNC(=O)C=Cc1cccs1)c1c[nH]c2ccccc12
MCULE-4102972705	0.64	C12C3C=CC=CC=3C=CC=1C(=O)CC(C1C=CC3=C(OCCO3)C=1)O2
MolPort-002-100-428	0.64	COc1ccc2[nH]cc(CCNC(=O)N(C)C)c2c1
MCULE-8926090259	0.64	C1(OC)C(O)=C2O[C@H](CC(C2=C(O)C=1)=O)C1C(O)=CC=CC=1
MolPort-006-762-609	0.64	CNC(=O)NCCc1c[nH]c2ccc(OC)cc12
MCULE-4005429744	0.64	C1C(=O)C2=C(O)C=C(O)C=C2O[C@@H]1C1C=CC(O)=CC=1
MolPort-045-968-956	0.64	O=C(NC1CCCN(CCc2ccccc2)C1)\C=C\c1c[nH]c2ccccc12
MCULE-5489217450	0.64	C12C(O)=CC(=CC=1OC(CC2=O)C1C=CC(=CC=1)O)O
MolPort-002-337-634	0.64	COc1cc(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)ccc1OCC(=O)Nc1ccccc1
MCULE-3335674808	0.64	OC1C=CC([C@@H]2OC3C(C(=O)[C@H]2O)=C(O)C=C(O)C=3C/C=C(\C)/C)=CC=1
MolPort-000-709-794	0.64	COc1ccc(\C=C(/NC(=O)c2ccc(cc2)C(C)(C)C)C(=O)NCCc2c[nH]c3ccccc23)cc1OC
MCULE-6480805780	0.64	C1(=O)C2=CC=CC=C2OC(C2C=CC=CC=2)C1O
MolPort-000-717-275	0.64	COc1ccc(\C=C(\NC(=O)c2ccc(OC)c(OC)c2)C(=O)NCCc2c[nH]c3ccccc23)cc1
MCULE-9081326862	0.64	CC(C(C1=CC=C(C)C=C1)=O)OC(C1=CC=C(OCC2OCCC2)C=C1)=O
MolPort-002-569-972	0.64	COc1ccc(cc1OC)C(=O)N\C(=C\c1cccc2ccccc12)C(=O)NCCc1c[nH]c2ccccc12
MCULE-4825912585	0.64	C12C3C=CC=CC=3OC(C)(C)C1O2
MolPort-002-966-639	0.64	COc1cc(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)c(Br)cc1OCC#C
MCULE-4477491477	0.64	COC1=CC(C(COC(C2=CC3=C(OCCO3)C=C2)=O)=O)=C(OC)C=C1
MolPort-002-722-703	0.64	COc1ccc(\C=C(/NC(=O)c2ccc(C)cc2)C(=O)NCCc2c(C)[nH]c3ccccc23)cc1
MCULE-9673811637	0.64	C1(O)C=C2C(=C(C=1)O)C1C(C(C3=CC(=C(O)C=C3)O)(O2)OC2C1=C1OC(C(C(C1=C(O)C=2)C1C(O)=CC(O)=C2CC(O)C(C3C=C(O)C(O)=CC=3)OC=12)O)C1C=C(O)C(O)=CC=1)O
MolPort-002-722-702	0.64	COc1ccc(\C=C(/NC(=O)c2ccc(OC)cc2)C(=O)NCCc2c(C)[nH]c3ccccc23)cc1
MolPort-002-722-693	0.64	COc1ccc(cc1)C(=O)N\C(=C/c1ccccc1)C(=O)NCCc1c(C)[nH]c2ccccc12
MolPort-002-332-709	0.64	COc1cc(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)cc(Br)c1OCc1cccc2ccccc12
MolPort-044-207-615	0.64	Clc1ccc(C=CC(=O)NCCc2c[nH]c3ccccc23)s1
MolPort-046-148-098	0.64	Cl.CC(=O)NCCc1c[nH]c2ccc(N)cc12
MolPort-002-011-546	0.64	C=CCNC(=O)C(=O)NCCc1c[nH]c2ccccc12
MolPort-046-622-762	0.64	COc1ccc2[nH]cc(CCNC(=O)C#CC)c2c1
MolPort-009-218-540	0.64	Fc1ccc(\C=C(/NC(=O)c2ccccc2)C(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-003-179-201	0.64	COc1ccc2[nH]cc(CCN3C(=O)CCC3=O)c2c1
MolPort-001-736-407	0.64	COc1ccc(cc1)C(=O)NCCc1c[nH]c2ccc(OC)cc12
MolPort-045-946-928	0.64	COc1ccc2[nH]cc(CCNC(=O)C3CC3(C)C)c2c1
MolPort-001-736-546	0.64	COc1ccc2[nH]cc(CCNC(=O)Cc3ccc(F)cc3)c2c1
MolPort-046-622-762	0.64	COc1ccc2[nH]cc(CCNC(=O)C#CC)c2c1
MolPort-046-452-512	0.64	Oc1ccc(C=CC(=O)NCCc2ccccc2)cc1O
MolPort-046-148-098	0.64	Cl.CC(=O)NCCc1c[nH]c2ccc(N)cc12
MolPort-002-555-181	0.64	Fc1ccc(\C=C(\NC(=O)c2ccccc2)C(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-044-296-799	0.64	Fc1ccc(C=C(NC(=O)c2ccccc2)C(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-001-736-409	0.64	COc1ccc2[nH]cc(CCNC(=O)Cc3ccc(Cl)cc3)c2c1
MolPort-044-394-124	0.64	COc1ccc(CCNC(=O)C=Cc2ccc3ccccc3n2)cc1OC
MolPort-002-569-478	0.64	CCN(CC)CC(=O)c1c[nH]c2ccc(OC)cc12
MolPort-044-211-422	0.64	Fc1ccc(CCNC(=O)C=Cc2cccnc2)cc1
MolPort-009-019-513	0.64	CC(O)=O.Cn1cc(C2=C(C(=O)NC2=O)c2cn(CCCN)c3ccccc23)c2ccccc12
MolPort-002-337-625	0.64	O=C(NCCc1c[nH]c2ccccc12)C(=C\c1ccco1)\C#N
MolPort-000-705-950	0.64	COc1ccccc1\C=C(/NC(=O)c1cccc(C)c1)C(=O)NCCc1c[nH]c2ccccc12
MolPort-002-216-605	0.64	COc1ccccc1\C=C(\NC(=O)c1cccc(C)c1)C(=O)NCCc1c[nH]c2ccccc12
MolPort-046-600-331	0.64	ClCC(=O)NCCc1c[nH]c2ccc(OCc3ccccc3)cc12
MolPort-003-187-168	0.64	CC(=O)NCCc1c[nH]c2ccc(OCC(O)=O)cc12
MolPort-005-605-049	0.64	COc1ccc(cc1)C(CNC(=O)CNC(C)(C)C)c1c[nH]c2ccccc12
MolPort-028-285-948	0.64	CN(C)C(=O)c1cccc(CCNC(=O)C=Cc2cccnc2)c1
MolPort-006-443-400	0.64	COCCCN(CC(=O)N(CCc1c[nH]c2ccccc12)Cc1ccccc1)C(=O)\C=C\c1ccc(cc1)[N+]([O-])=O
MolPort-027-807-697	0.64	COc1ccc2[nH]c(C)c(CCNC(=O)CCl)c2c1
MolPort-044-561-087	0.64	NCCCn1cc(C2=C(C(=O)NC2=O)c2c[nH]c3ccccc23)c2ccccc12
MolPort-028-611-167	0.64	Cn1cc(C(O)CNC(=O)\C=C\c2cccs2)c2ccccc12
MolPort-006-705-176	0.64	Cl.NCC(=O)NCCc1c[nH]c2ccccc12
MolPort-001-018-383	0.64	COc1ccc(\C=C\C(=O)NCCc2ccccc2)cc1
MolPort-009-252-393	0.64	Cc1ccc(O)c(c1)C(=O)NCCc1c[nH]c2ccccc12
MolPort-009-029-538	0.64	COc1ccc(cc1)C(CNC(=O)Cc1ccccc1)c1c[nH]c2ccccc12
MolPort-003-033-226	0.64	COc1ccc2cc(CCNC(=O)\C=C/c3ccc4OCOc4c3)c(=O)[nH]c2c1
MolPort-044-561-087	0.64	NCCCn1cc(C2=C(C(=O)NC2=O)c2c[nH]c3ccccc23)c2ccccc12
MolPort-001-736-431	0.64	COc1ccc2[nH]cc(CCNC(=O)c3ccc(C)cc3)c2c1
MolPort-003-983-882	0.64	CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)NCCc1c[nH]c2ccc(O)cc12
MolPort-000-716-350	0.64	COc1ccc(cc1)C(=O)N\C(=C\c1ccc(OC)c(OC)c1)C(=O)NCCc1c[nH]c2ccccc12
MolPort-027-807-697	0.64	COc1ccc2[nH]c(C)c(CCNC(=O)CCl)c2c1
MolPort-028-285-948	0.64	CN(C)C(=O)c1cccc(CCNC(=O)C=Cc2cccnc2)c1
MolPort-000-845-956	0.64	COc1ccc2[nH]cc(CCNC(=O)c3ccccc3OC)c2c1
MolPort-002-279-482	0.64	ClC(Cl)C(=O)NCCc1c[nH]c2ccccc12
MolPort-001-512-752	0.64	Cl.COc1ccc2[nH]cc(CCNC(C)C)c2c1
MolPort-003-033-429	0.64	Cc1ccc2cc(CCNC(=O)\C=C/c3ccc4OCOc4c3)c(=O)[nH]c2c1C
MolPort-042-676-096	0.64	Cc1[nH]c2ccccc2c1CCNCc1ccc(C=CC(=O)NO)cc1
MolPort-005-917-931	0.64	O=C(CCc1c[nH]c2ccccc12)N1CCN(CC1)C(=O)\C=C\c1ccccc1
MolPort-035-945-076	0.64	CCOc1ccc2[nH]cc(CC(=O)NC(C)C)c2c1
MolPort-001-536-204	0.64	O=C(Cc1ccccc1)NCCc1c[nH]c2ccccc12
MolPort-002-301-647	0.64	COc1ccc2c(CCNC(=O)C(c3ccccc3)c3ccccc3)c[nH]c2c1
MolPort-002-050-426	0.64	CCOC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)\C=C\c1ccc(F)cc1
MolPort-002-560-898	0.64	Clc1ccccc1\C=C(\NC(=O)c1ccccc1)C(=O)NCCc1c[nH]c2ccccc12
MolPort-044-254-029	0.64	COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C=Cc1ccc(cc1)C(=O)OC
MolPort-002-174-906	0.64	Clc1ccccc1\C=C(/NC(=O)c1ccccc1)C(=O)NCCc1c[nH]c2ccccc12
MolPort-005-045-855	0.64	O=C(Cc1c[nH]c2ccccc12)N1CCC2(CC2C(=O)N2CCN(C\C=C\c3ccccc3)CC2)CC1
MolPort-008-332-714	0.63	Cn1cc(\C=C(/C#N)C(=O)NCCc2ccccc2)c2ccccc12
MolPort-042-671-981	0.63	Cn1cc(CC(=O)NCCc2ccc(O)c(O)c2)c2ccccc12
MolPort-004-080-080	0.63	COc1ccc(cc1)C(CNC(=O)C1CC1)c1c[nH]c2ccccc12
MolPort-005-916-902	0.63	COc1ccc(CC(=O)NCCc2c[nH]c3ccc(Cl)cc23)cc1
MolPort-039-000-541	0.63	CCN(CCCN(C)C)C(=O)Cc1c[nH]c2ccc(OC)cc12
MolPort-004-897-133	0.63	CCC(CC)C(=O)NCC(c1c[nH]c2ccccc12)c1ccc(OC)cc1
MolPort-009-029-539	0.63	COc1ccc(cc1)C(CNC(=O)Cc1c[nH]c2ccccc12)c1c[nH]c2ccccc12
MolPort-002-175-108	0.63	CSc1ccc(\C=C(\NC(=O)c2ccccc2)C(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-002-714-930	0.63	Cc1[nH]c2ccccc2c1CCNC(=O)C(\NC(=O)c1ccccc1)=C\c1ccccc1
MolPort-009-252-416	0.63	Oc1ccc(Cl)cc1C(=O)NCCc1c[nH]c2ccccc12
MolPort-009-252-415	0.63	Oc1ccc(Br)cc1C(=O)NCCc1c[nH]c2ccccc12
MolPort-002-512-426	0.63	Cc1cc(C)cc(CC(=O)NCCc2c[nH]c3ccccc23)c1
MolPort-003-823-939	0.63	COc1ccc2[nH]c(Br)c(CCNC(C)=O)c2c1
MolPort-003-033-325	0.63	Cc1ccc(C)c2[nH]c(=O)c(CCNC(=O)\C=C/c3ccc4OCOc4c3)cc12
MolPort-002-513-951	0.63	COc1ccc2[nH]cc(C(=O)CN(C)C)c2c1
MolPort-044-295-083	0.63	O=C(NCCc1c[nH]c2ccccc12)C(NC(=O)c1ccccc1)=Cc1ccncc1
MolPort-003-940-494	0.63	Cl.CN(C)CCCn1cc(C2=C(C(=O)NC2=O)c2c[nH]c3ccccc23)c2ccccc12
MolPort-002-866-493	0.63	CC1(C)CN(CCc2c[nH]c3ccccc23)C1=O
MolPort-001-742-339	0.63	O=CNCCc1c[nH]c2ccccc12
MolPort-004-190-452	0.63	O=C(NCCc1c[nH]c2ccccc12)C(c1ccccc1)c1ccccc1
MolPort-002-541-353	0.63	FC(F)(F)C(=O)NCCc1c[nH]c2ccccc12
MolPort-002-966-723	0.63	[O-][N+](=O)c1cc(ccc1Oc1ccc(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)cc1)C(F)(F)F
MolPort-019-663-680	0.63	COc1cc(OC)cc(C=CC(=O)N2CCc3c([nH]c4ccccc34)C2C)c1
MolPort-003-860-032	0.63	COc1cccc(\C=C(\C#N)C(=O)NCCc2c[nH]c3ccccc23)c1OC(C)C(O)=O
MolPort-020-146-925	0.63	O=C(C=Cc1cccnc1)N(CCc1ccccc1)Cc1ccncc1
MolPort-001-736-434	0.63	COc1ccc2[nH]cc(CCNC(=O)c3ccccc3C)c2c1
MolPort-046-703-443	0.63	COCC(=O)NCCc1c(C)[nH]c2ccc(O)cc12
MolPort-001-544-173	0.63	COc1ccc(CCNC(=O)\C=C\c2cccc(Cl)c2)cc1
MolPort-001-492-774	0.63	COc1ccc(\C=C\C(=O)NCCc2cccc(Cl)c2)cc1
MolPort-028-894-981	0.63	COc1ccc2[nH]cc(CC(=O)N(C)C)c2c1
MolPort-009-861-607	0.63	[O-][N+](=O)c1cc2OCOc2cc1\C=C\C(=O)NCCc1c[nH]c2ccccc12
MolPort-020-017-216	0.63	CC(C)C(=O)NCC(c1c[nH]c2ccccc12)c1ccccc1
MolPort-002-966-938	0.63	[O-][N+](=O)c1ccc(COc2ccc(\C=C(/C#N)C(=O)NCCc3c[nH]c4ccccc34)cc2Br)cc1
MolPort-044-545-402	0.63	COc1ccc2[nH]cc(CCNC(=O)Cn3ccc4cc(C)ccc34)c2c1
MolPort-002-511-869	0.63	COC(=O)NCCc1c[nH]c2ccc(OC)cc12
MolPort-000-912-023	0.63	CCC(CC)C(=O)NCCc1c[nH]c2cc(OC)ccc12
MolPort-005-551-486	0.63	CC(C)(C)NCC(=O)NCCc1c[nH]c2ccccc12
MolPort-002-591-741	0.63	CC(C)Oc1ccc(\C=C\C(=O)NCCc2ccccc2)cc1
MolPort-001-501-752	0.63	COc1ccc(CCNC(=O)\C=C\c2ccc(cc2)C(C)C)cc1
MolPort-002-048-414	0.63	CCOc1ccc(\C=C\C(=O)NCCc2ccccc2)cc1
MolPort-006-305-520	0.63	COc1ccc2[nH]cc(CC[N+](C)(C)C)c2c1
MolPort-044-211-517	0.63	CC(C)C(CNC(=O)C=Cc1cccnc1)c1ccccc1
MolPort-046-728-548	0.63	CC(Cc1c[nH]c2ccc(F)cc12)NC(=O)C=C
MolPort-001-736-430	0.63	COc1ccc2[nH]cc(CCNC(=O)c3ccc(Br)cc3)c2c1
MolPort-046-779-317	0.63	COc1ccc(\C=C\CN2CCCN(CC2)C(=O)Cc2cccnc2)cc1
MolPort-045-962-277	0.63	COc1ccc2[nH]cc(CCNC(=O)C3CN(CC=C)C(=O)C3)c2c1
MolPort-001-535-152	0.63	COc1ccc(CCNC(=O)C(=C\c2c(C)[nH]c3ccccc23)\C#N)cc1
MolPort-003-824-458	0.63	CN(C)CCCn1cc(C2=C(C(=O)NC2=O)c2c[nH]c3ccccc23)c2ccccc12
MolPort-002-130-566	0.63	Oc1ccc2[nH]cc(CCNC(c3ccccc3)(c3ccccc3)c3ccccc3)c2c1
MolPort-004-219-028	0.63	Brc1ccc(CC(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-000-766-484	0.63	[O-]c1ccc2[nH]cc(CC[NH2+]C(c3ccccc3)(c3ccccc3)c3ccccc3)c2c1
MolPort-006-189-275	0.63	Cc1ccc2[nH]cc(CCNC(=O)CCl)c2c1
MolPort-008-347-150	0.63	COc1ccc2n(CC(=O)NCCc3c[nH]c4ccc(OC)cc34)ccc2c1
MolPort-008-011-810	0.63	O=C(\C=C\c1ccccc1)N(CCc1ccncc1)c1ccccc1
MolPort-019-950-460	0.63	COc1ccc2[nH]cc(CCNC(=O)Cn3ccc4ccccc34)c2c1
MolPort-044-242-317	0.63	OC(CNC(=O)C=Cc1cc(Cl)cc(Cl)c1)c1ccncc1
MolPort-001-887-703	0.63	Oc1ccc2[nH]cc(CCN3C(=O)c4ccccc4C3=O)c2c1
MolPort-010-414-885	0.63	Fc1cc(F)cc(CCNC(=O)C=Cc2ccc(OCc3cccnc3)cc2)c1
MolPort-002-242-092	0.63	COc1cc(\C=C(/NC(=O)c2ccccc2)C(=O)NCCc2c[nH]c3ccccc23)cc(OC)c1OC
MolPort-002-714-951	0.63	CC(C)Oc1ccc(\C=C(/NC(=O)c2ccccc2)C(=O)NCCc2c(C)[nH]c3ccccc23)cc1
MolPort-001-736-401	0.63	COc1ccc2[nH]cc(CCNC(=O)CNC(=O)CCl)c2c1
MolPort-039-341-861	0.63	CC1=C(C)C(=O)N(CCc2c(C)[nH]c3c(C)cccc23)C1=O
MolPort-003-253-635	0.63	FC(F)Oc1ccc(CCNC(=O)Cc2c[nH]c3ccccc23)cc1
MolPort-005-670-978	0.63	COc1ccc(cc1)C(CNC(=O)CC(C)(C)C)c1c[nH]c2ccccc12
MolPort-003-033-062	0.63	COc1cc(\C=C/C(=O)NCCc2cc3c(OC)ccc(OC)c3[nH]c2=O)cc(OC)c1OC
MolPort-009-029-540	0.63	CCCC(=O)NCC(c1c[nH]c2ccccc12)c1ccc(OC)cc1
MolPort-009-169-374	0.63	Fc1ccccc1CCNC(=O)C=Cc1cccnc1
MolPort-028-270-497	0.63	COc1ccc2[nH]cc(CCNC(=O)C(C)CSC)c2c1
MolPort-044-543-491	0.63	COc1ccc2n(CCC(=O)NCCc3c[nH]c4ccc(OC)cc34)ccc2c1
MolPort-028-855-257	0.63	COc1ccc2[nH]cc(CCNC(=O)CCn3ccc4ccccc34)c2c1
MolPort-002-332-761	0.63	O=C(NCCc1c[nH]c2ccccc12)C(=C\c1ccsc1)\C#N
MolPort-001-908-482	0.63	O=C(NCCc1c[nH]c2ccccc12)C(=C/c1ccsc1)\C#N
MolPort-002-966-712	0.63	CCOc1cc(\C=C(\C#N)C(=O)NCCc2c[nH]c3ccccc23)cc(Cl)c1OCc1ccc(cc1)C(O)=O
MolPort-019-950-525	0.63	COc1ccc2[nH]cc(CCNC(=O)c3ccc4n(C)ccc4c3)c2c1
MolPort-002-858-183	0.63	COc1ccc2[nH]cc(CCNC(=O)NC(C)(C)C)c2c1
MolPort-009-583-884	0.63	CN(CCc1ccncc1)C(=O)CNC(=O)C=Cc1ccccc1
MolPort-000-819-032	0.63	CCC(C)C(=O)NCCc1c[nH]c2cc(OC)ccc12
MolPort-023-194-527	0.63	Cc1ccc(CCNC(=O)CNC(=O)C=Cc2ccccc2)cn1
MolPort-044-873-355	0.63	OC(C(=O)N1CC=C(C1)c1cccc2ccccc12)c1cccnc1
MolPort-002-715-093	0.63	COc1ccc(\C=C(/NC(=O)c2ccc(Br)cc2)C(=O)NCCc2c(C)[nH]c3ccccc23)cc1
MolPort-001-502-644	0.63	COc1ccc(CCNC(=O)\C=C\c2ccc(C)cc2)cc1
MolPort-009-505-522	0.63	COc1ccc(cc1)C(CNC(=O)CC(C)C)c1c[nH]c2ccccc12
MolPort-028-856-393	0.63	CC(C)n1cc(CC(=O)NCCc2ccc(O)cc2)c2ccccc12
MolPort-005-909-826	0.63	COc1ccc(CCC(=O)NCCc2c[nH]c3ccc(OC)cc23)cc1
MolPort-001-736-390	0.63	CCCCCCCCCCCC(=O)NCCc1c[nH]c2ccc(OC)cc12
MolPort-042-671-981	0.63	Cn1cc(CC(=O)NCCc2ccc(O)c(O)c2)c2ccccc12
MolPort-044-543-491	0.63	COc1ccc2n(CCC(=O)NCCc3c[nH]c4ccc(OC)cc34)ccc2c1
MolPort-039-341-861	0.63	CC1=C(C)C(=O)N(CCc2c(C)[nH]c3c(C)cccc23)C1=O
MolPort-020-146-925	0.63	O=C(C=Cc1cccnc1)N(CCc1ccccc1)Cc1ccncc1
MolPort-046-703-443	0.63	COCC(=O)NCCc1c(C)[nH]c2ccc(O)cc12
MolPort-028-894-981	0.63	COc1ccc2[nH]cc(CC(=O)N(C)C)c2c1
MolPort-044-545-402	0.63	COc1ccc2[nH]cc(CCNC(=O)Cn3ccc4cc(C)ccc34)c2c1
MolPort-020-017-216	0.63	CC(C)C(=O)NCC(c1c[nH]c2ccccc12)c1ccccc1
MolPort-039-000-541	0.63	CCN(CCCN(C)C)C(=O)Cc1c[nH]c2ccc(OC)cc12
MolPort-044-295-083	0.63	O=C(NCCc1c[nH]c2ccccc12)C(NC(=O)c1ccccc1)=Cc1ccncc1
MolPort-046-728-548	0.63	CC(Cc1c[nH]c2ccc(F)cc12)NC(=O)C=C
MolPort-044-211-517	0.63	CC(C)C(CNC(=O)C=Cc1cccnc1)c1ccccc1
MolPort-028-855-257	0.63	COc1ccc2[nH]cc(CCNC(=O)CCn3ccc4ccccc34)c2c1
MolPort-028-270-497	0.63	COc1ccc2[nH]cc(CCNC(=O)C(C)CSC)c2c1
MolPort-019-950-525	0.63	COc1ccc2[nH]cc(CCNC(=O)c3ccc4n(C)ccc4c3)c2c1
MolPort-044-873-355	0.63	OC(C(=O)N1CC=C(C1)c1cccc2ccccc12)c1cccnc1
MolPort-023-194-527	0.63	Cc1ccc(CCNC(=O)CNC(=O)C=Cc2ccccc2)cn1
MolPort-028-856-393	0.63	CC(C)n1cc(CC(=O)NCCc2ccc(O)cc2)c2ccccc12
MolPort-045-962-277	0.63	COc1ccc2[nH]cc(CCNC(=O)C3CN(CC=C)C(=O)C3)c2c1
MolPort-046-779-317	0.63	COc1ccc(\C=C\CN2CCCN(CC2)C(=O)Cc2cccnc2)cc1
MolPort-044-242-317	0.63	OC(CNC(=O)C=Cc1cc(Cl)cc(Cl)c1)c1ccncc1
MolPort-019-950-460	0.63	COc1ccc2[nH]cc(CCNC(=O)Cn3ccc4ccccc34)c2c1
MCULE-1363046696	0.63	C12OC(=O)C3(C4C(O)=CC(O)=CC=4OC3C3C=C(O)C(O)=CC=3)C1=C1OC(C3C=C(O)C(O)=CC=3)C(O)CC1=C(O)C=2
MCULE-4107309014	0.63	C1(OC)C=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(O)C=1C
MCULE-8195585327	0.63	C1(O)C(C)=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(O)C=1
MCULE-4359209086	0.63	C1(OC)C=C2O[C@H](C3C=CC(O)=CC=3)CCC2=C(O)C=1C
MCULE-9719350138	0.63	C12(OCCO1)C(C1C(OC)=C(C(OC(C)C)=CC2=1)CCCC)=O
MCULE-6580599773	0.63	C1(O)C(C)=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(O)C=1C
MCULE-6753110271	0.63	C12=C(C)C(O)=CC(O)=C1C(C[C@@H](C1C=CC=CC=1)O2)=O
MCULE-5637234780	0.63	C1(O)C=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=CC=1
MCULE-6631561492	0.63	C1C(=O)C2C(=CC(O)=CC=2O)O[C@@H]1C1C=CC=CC=1
MCULE-1702737025	0.63	C1(O)C(OC)=C2O[C@H](C3C=CC=CC=3O)CC(=O)C2=C(OC)C=1
MCULE-2862082028	0.63	C1(OC)C=C2O[C@H](C3C=CC(OC)=CC=3)CC(=O)C2=C(O)C=1
MCULE-1420104540	0.63	C1(OC)C(OC)=C2[C@@]3(O[C@H](CO)[C@@H](O)[C@H](O)[C@]3(OC(=O)C2=CC=1OC)[H])[H]
MCULE-9370973230	0.63	C1(O)C=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(O)C=1
MCULE-6698275589	0.63	C1(O)C=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(OC)C=1
MCULE-4496634668	0.63	C1(O)C=C2O[C@H](C3C=CC(O)=C(OC4C=CC([C@@H]5CC(=O)C6C(O)=CC(O)=CC=6O5)=CC=4)C=3)CC(=O)C2=C(O)C=1
MCULE-2006795805	0.63	FC1=CC=C(COCC2OC3=C(C=C(C(O)=O)C=C3)C2)C=C1
MCULE-3283255181	0.63	C12OC(C)(C)CCC=1C(=C1CCC(C)(C)OC1=C2OC)C(OC)=O
MCULE-3129653084	0.63	COC1=CC(OC)=C(C(COC(COC2=C3C(CC(O3)(C)C)=CC=C2)=O)=O)C=C1
MCULE-9865914914	0.63	C1(O)C=C2OC(CC(C2=C(OC)C=1)=O)C1C=CC(O)=CC=1
MCULE-3240859900	0.63	C1(OC)C=C2OC(CC(=O)C2=C(O)C=1)C1C=CC(O)=CC=1
MCULE-1297538743	0.63	C1(OC)C=C2O[C@@H](CC(=O)C2=C(O)C=1)C1C=CC(O)=CC=1
MCULE-9302131889	0.63	C1(O)C=C2OC(C3C=CC=CC=3)CC(=O)C2=C(O)C=1
MCULE-9439004515	0.63	C12C(O)=CC(=CC=1OC(CC2=O)C1C=CC(=CC=1)OC)O
MCULE-4316808464	0.63	O(C1C(C(C(CO)OC1C1C(O)=CC(=C(C(=O)C2C=CC(O)=CC=2)C=1O)O)O)O)C(=O)C1C=C(O)C(O)=C(O)C=1
MCULE-6813410114	0.63	C12=CC(OCC3C=CC=CC=3)=C(C=C1OC(C)(C)CC2=O)OCC1C=CC=CC=1
MCULE-2064774552	0.63	OC1C=CC(C2OC3=CC(O)=CC=C3C(=O)C2)=CC=1
MCULE-8968944056	0.63	C1(O)C(=C2OC(C3C=CC(O)=CC=3)CC(C2=C(O)C=1C1C(O)C(O)C(O)C(CO)O1)=O)C1C(O)C(O)C(O)C(CO)O1
MCULE-5306878717	0.63	C12=CC(O)=CC=C1C(=O)C[C@@]([H])(C1C=CC(=CC=1)O)O2
MCULE-4493065840	0.63	C12=CC(OC)=CC=C1O[C@@H](CC2=O)C1C=CC(=C(OC)C=1)OC
MCULE-5001672302	0.63	C1(C)C(O)=C2C(CC(OC2=C(C)C=1O)C1C=CC(O)=CC=1)=O
MCULE-3959877697	0.63	COC1=C(OCC2=CC=CC=C2)C=CC(C(OCC(C2=CC3=C(OCCO3)C=C2)=O)=O)=C1
MCULE-2173614521	0.63	O=C(C1=CC=CC=C1)COC(C1=CC=C(OCC2OCCC2)C=C1)=O
MCULE-7323006668	0.63	OC1=CC(O)=C(C(COC(COC2=CC3=C(CCC3)C=C2)=O)=O)C=C1
MCULE-4065402213	0.63	C12C=C(OC)C=CC=1OC(CC2=O)C1C=CC(=C(OC)C=1)OC
MCULE-9340369205	0.63	OC1=CC(O)=C(C(COC(C2=CC3=C(OCCO3)C=C2)=O)=O)C=C1
MCULE-6964743359	0.63	C12C(O)=CC(=CC=1O[C@@H](CC2=O)C1C=CC(=CC=1)OC)O
MCULE-7104867839	0.63	C1(C)C(O)=C2C(CC(OC2=CC=1O)C1C=CC(O)=CC=1)=O
MCULE-6273466258	0.62	C1(O)C(C/C=C(\C)/C)=C2O[C@H](C3C(O)=CC(O)=CC=3)[C@@H](O)C(=O)C2=C(O)C=1C/C=C(\C)/C
MCULE-6446812002	0.62	C12C(O)=C(OC)C(=CC=1C(=O)O[C@]1([H])[C@H]([C@H](O)[C@@H](CO)O[C@]12[H])O)O
MCULE-2424476488	0.62	C12C=C(O)C=CC=1OC(CC2=O)C1=CC=CC=C1
MCULE-8726416131	0.62	C1(O)C=C2O[C@@H](C3C=CC=CC=3)CC(=O)C2=CC=1
MCULE-3722830096	0.62	C1(O)C=C2OC[C@](O)(CC3C=CC(O)=CC=3)[C@H](OC)C2=CC=1
MCULE-8498690406	0.62	COC1=CC(OC)=CC2=C1C(=O)CC(C1=CC=C(OC)C=C1)O2
MCULE-8473479842	0.62	OC1C(C/C=C(\C)/C)=CC(=CC=1OC)C1OC2C(C(=O)C1)=C(C=C(C=2)O)O
MCULE-7826903505	0.62	C1(O)C=C2OC(C3C=CC=CC=3)CC(C2=C(OC)C=1)=O
MCULE-4547911471	0.62	C1(OC)C(C)=C2O[C@H](C3C=CC(O)=CC=3)CC(=O)C2=C(O)C=1C
MCULE-1272280425	0.62	C12C(=O)CC(OC=1C=C(OC)C(C)=C2O)C1C=CC=CC=1
MCULE-7259979801	0.62	C1(O)C=C2O[C@H](C3C=CC(O)=CC=3O)CC(=O)C2=C(O)C=1
MCULE-7442958115	0.62	OC1C=CC(C2OC3C(C(=O)C2)=C(O)C=C(O)C=3)=C(O)C=1
MCULE-3478912469	0.62	C(COC1=CC=CC=C1C)(=O)OCC(=O)C1C=CC(=CC=1)OCC1=CC=CC=C1
MCULE-6079143314	0.62	C1(=CC=C(C=C1)C(=O)OC1C=C(C(=O)OCCOC2C=CC(C(=O)CCCC)=CC=2)C(O)=CC=1)OCCCCCCCC
MCULE-7615488568	0.62	C1(OC)C(O)=C2[C@@]3(O[C@H](COC(C4C=C(O)C(O)=C(O)C=4)=O)[C@@H](O)[C@H](O)[C@]3(OC(=O)C2=CC=1O)[H])[H]
MCULE-7196504979	0.62	C1(OC)C=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(O)C=1
MCULE-6489590055	0.62	C1(O)C=C2OC[C@@]3(O)C4C=CC(OC)=C(C[C@H](O)C(O)(C)C)C=4O[C@@]3([H])C2=CC=1
MCULE-5423915532	0.62	C1(OC(=O)C)C=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(O)C=1
MCULE-3703285153	0.62	C1(O)C=C2O[C@H](C3C(O)=C(C/C=C(\C)/C)C(O)=C(C/C=C(\C)/C)C=3)[C@@H](O)C(=O)C2=C(O)C=1
MCULE-9790777412	0.62	C1(O)C=C2OC[C@](O)(CC3C=CC(O)=CC=3)[C@@H](OC)C2=CC=1
MCULE-8068976578	0.62	C12C(OC)=CC(=CC=1OC(CC2=O)C1C=CC(=CC=1)O)OC
MCULE-3415422519	0.62	COC1=C(OC)C(OC)=CC(C(COC(C2=CC3=C(OCCO3)C=C2)=O)=O)=C1
MCULE-8139621595	0.62	C1(O)C(C/C=C(\C)/C)=C2O[C@H](C3C=CC(O)=CC=3)[C@@H](O)C(=O)C2=C(OC)C=1
MCULE-6451111457	0.62	C12C=C(O)C=CC=1O[C@](CC2=O)([H])C1=CC=CC=C1
MCULE-7103143686	0.62	C1(OC(=O)C)C=C2O[C@H](C3C=CC(OC(=O)C)=CC=3)CC(=O)C2=C(O)C=1
MCULE-7277320014	0.62	C1C=C2C(=O)C3(O)C4C=C(OC)C(OC)=CC=4OCC3OC2=C2CC(C(O)(C)C)OC=12
MCULE-9027148478	0.62	O(C1C(O)C(O)C(CO)OC1C1C(O)=C2C(=O)CC(C3C=CC(O)=CC=3)OC2=CC=1O)C1C(O)C(C(CO1)O)O
MCULE-5872540603	0.62	C1C=C2C(=O)C3(O)C4C=C(OC)C(OC)=CC=4OCC3OC2=C2CC(C(O)(CO)C)OC=12
MCULE-6080588477	0.62	C1(OC)C(O)=C2[C@@]3(O[C@H](CO)[C@@H](O)[C@H](OC(C4C=C(O)C(O)=C(O)C=4)=O)[C@]3(OC(=O)C2=CC=1O)[H])[H]
MCULE-2515161908	0.62	O=C(C1=CC2=C(CCC2)C=C1)COC(C1=CC2=C(OCCO2)C=C1)=O
MCULE-4339356924	0.62	C1(O[C@H]2[C@H](O)[C@](CO)(O)CO2)C=C2O[C@H](C3C=CC(O)=CC=3)[C@@H](O)CC2=C(O)C=1
MCULE-3324744620	0.62	[C@H]1(C2=CC=C(C)C=C2)OC2=C(C=CC=C2)C(=O)[C@@]1(O)C
MCULE-4427780251	0.62	C12=C(C)C(OC)=CC(O)=C1C(CC(C1C=CC=CC=1)O2)=O
MCULE-3642569299	0.62	C1C=C2C(=O)[C@@]3(O)C4C=C(OC)C(OC)=CC=4OC[C@@]3([H])OC2=C2C[C@H](C(O)(C)C)OC=12
MCULE-1231893585	0.62	C1(OC)C=C2O[C@H](C3C=CC(OC)=CC=3)CC(=O)C2=C(OC)C=1
MCULE-6305563775	0.62	C1(O)C=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(OC)C=1
MCULE-8084114235	0.62	[C@H]1(C2=CC=CC=C2)OC2=CC(O)=CC(OC)=C2C(=O)C1
MolPort-007-564-194	0.62	O=C(NCCc1c[nH]c2ccccc12)C(\NC(=O)c1ccccc1)=C\c1cccnc1
MolPort-004-896-863	0.62	COc1ccc(cc1)C(CNC(=O)c1ccccc1)c1c[nH]c2ccccc12
MolPort-002-948-187	0.62	[O-][N+](=O)c1ccc(COc2ccccc2\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-000-806-380	0.62	COc1cc(N2CCCC2)c(OC)cc1\C=C(/C#N)C(=O)NCCc1c[nH]c2ccccc12
MolPort-001-779-633	0.62	NCCc1c[nH]c2ccc(O)cc12
MolPort-044-255-638	0.62	FC(F)Oc1ccc(CCNC(=O)C=Cc2ccc(OC(F)F)cc2)cc1
MolPort-045-901-226	0.62	Cl.COc1ccc2[nH]cc(CCNCCS)c2c1
MolPort-001-736-384	0.62	COc1ccc2[nH]cc(CCNC(=O)c3cccnc3)c2c1
MolPort-002-714-931	0.62	Cc1[nH]c2ccccc2c1CCNC(=O)C(\NC(=O)c1ccc(Br)cc1)=C\c1ccccc1
MolPort-002-318-765	0.62	O=C(\C=C\c1c[nH]c2ccccc12)N1CCCCC1
MolPort-002-020-610	0.62	COc1ccc2c(CCNC(=O)c3cccc4ccccc34)c[nH]c2c1
MolPort-028-745-471	0.62	CN1C(=O)C(Br)=C(C1=O)c1c[nH]c2ccccc12
MolPort-005-508-771	0.62	COc1ccc(CC(=O)NCC(c2c[nH]c3ccccc23)c2ccc(cc2)N(C)C)cc1
MolPort-009-766-703	0.62	Cl.Cc1c(C(=O)CN2CCN(C\C=C\c3ccccc3)CC2)c2ccccc2n1C
MolPort-004-230-061	0.62	O=C(Cc1c[nH]c2ccccc12)NCCc1ccccc1
MolPort-001-736-153	0.62	COc1ccc2[nH]cc(CCNC(=O)C(\NC(=O)c3ccccc3)=C\c3cn(C)c4ccccc34)c2c1
MolPort-020-017-114	0.62	CC(CNC(=O)Cc1c[nH]c2ccccc12)c1ccccc1
MolPort-016-617-960	0.62	CCN(C\C=C\c1ccccc1)C(=O)Cc1ccncc1
MolPort-002-536-126	0.62	O=C(Cc1c[nH]c2ccccc12)NCCc1c[nH]c2ccccc12
MolPort-006-755-815	0.62	O=C(NCCc1c[nH]c2ccccc12)C1CC1
MolPort-002-732-905	0.62	CC(=O)N\C(=C\c1ccccc1)C(=O)NC(Cc1c[nH]c2ccccc12)C(O)=O
MolPort-020-180-732	0.62	CC(=O)N\C(=C/c1ccccc1)C(=O)NC(Cc1c[nH]c2ccccc12)C(O)=O
MolPort-020-136-801	0.62	O=C(NC1CCN(CCc2ccncc2)CC1)C=Cc1ccccc1
MolPort-009-146-444	0.62	COc1cc(CC(=O)NCCc2c[nH]c3ccccc23)ccc1C
MolPort-000-719-035	0.62	[Cl-].Cc1c(C(=O)CN2CC[NH+](C\C=C\c3ccccc3)CC2)c2ccccc2n1C
MolPort-009-036-512	0.62	Oc1ccccc1CCC(=O)NCCc1c[nH]c2ccccc12
MolPort-001-740-424	0.62	OC(CNC(=O)\C=C\c1ccc(O)cc1)c1ccc(O)cc1
MolPort-002-101-109	0.62	COc1ccc2c(CCNC(=O)c3ccccc3)c[nH]c2c1
MolPort-001-736-403	0.62	Oc1ccc2[nH]cc(CCNC(=O)C3CCCNC3=O)c2c1
MolPort-002-561-415	0.62	COc1ccc(cc1OC)C(=O)N\C(=C/c1ccc(Br)cc1)C(=O)NCCc1c[nH]c2ccccc12
MolPort-009-025-033	0.62	COc1cc(C=CC)ccc1OCC(=O)NCCc1c[nH]c2ccccc12
MolPort-004-972-736	0.62	COc1ccc(cc1)C(NCCc1c[nH]c2ccc(OC)cc12)=C1C(=O)N(C)C(=O)N(C)C1=O
MolPort-009-573-552	0.62	FC(F)(F)CN(CC=C)C(=O)Cc1c[nH]c2ccccc12
MolPort-044-209-553	0.62	CCOc1c(Cl)cc(C=CC(=O)NC(Cc2c[nH]c3ccccc23)C(=O)OC)cc1OC
MolPort-002-966-634	0.62	COC(=O)Cn1cc(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)c2ccccc12
MolPort-044-416-893	0.62	COC(=O)Cn1cc(C=C(C#N)C(=O)NCCc2c[nH]c3ccccc23)c2ccccc12
MolPort-001-736-387	0.62	COc1ccc2[nH]cc(CCNC(=O)c3ccc(Cl)cc3)c2c1
MolPort-005-921-866	0.62	COc1ccc2[nH]cc(CCNC(=O)CCNC(=O)C(c3ccccc3)c3ccccc3)c2c1
MolPort-005-517-792	0.62	COc1ccc(cc1)C(CNC(=O)CN1CCN(CC1)C(C)=O)c1c[nH]c2ccccc12
MolPort-001-736-484	0.62	COc1ccc2[nH]cc(CCNC(=O)COc3ccccc3)c2c1
MolPort-000-164-860	0.62	COc1ccc2[nH]cc(CCNC(=O)CCC(O)=O)c2c1
MolPort-003-983-674	0.62	Cl.Oc1ccc2[nH]cc(CCCCN3CCC(=CC3)c3ccccc3)c2c1
MolPort-038-936-247	0.62	O=C(NCCc1cncnc1)\C=C\c1ccccc1
MolPort-002-126-195	0.62	O=C(NCCc1c[nH]c2ccccc12)C(=O)NCCc1ccccc1
MolPort-028-611-196	0.62	Cn1cc(C(O)CNC(=O)\C=C\c2ccsc2)c2ccccc12
MolPort-002-987-268	0.62	CC(C)CNC(=O)C(=O)NCCc1c[nH]c2ccccc12
MolPort-044-240-155	0.62	COc1ccc(CCNC(=O)C=Cc2cccc(OC)c2)cc1
MolPort-000-702-801	0.62	CC(C)NC(=O)C(=O)NCCc1c[nH]c2ccccc12
MolPort-002-011-457	0.62	CCNC(=O)C(=O)NCCc1c[nH]c2ccccc12
MolPort-003-650-564	0.62	O=C(NCCc1c[nH]c2ccccc12)C(=O)NCCc1c[nH]c2ccccc12
MolPort-002-011-574	0.62	CNC(=O)C(=O)NCCc1c[nH]c2ccccc12
MolPort-003-644-851	0.62	CCCNC(=O)C(=O)NCCc1c[nH]c2ccccc12
MolPort-001-489-380	0.62	COc1ccc(CCNC(=O)\C=C\c2ccc(Br)cc2)cc1
MolPort-002-966-711	0.62	COc1cc(\C=C(\C#N)C(=O)NCCc2c[nH]c3ccccc23)cc(Br)c1OCc1ccc(cc1)C(O)=O
MolPort-002-552-208	0.62	Fc1ccccc1\C=C(\NC(=O)c1ccccc1)C(=O)NCCc1c[nH]c2ccccc12
MolPort-044-222-770	0.62	Cn1cc(cn1)C(C)(O)CNC(=O)C=Cc1ccnc2ccccc12
MolPort-002-146-000	0.62	COc1ccc(\C=C\C(=O)NC(C)Cc2ccccc2)cc1
MolPort-002-337-630	0.62	Cc1ccc(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)s1
MolPort-029-906-793	0.62	Cl.CCNCC(=O)NCCc1c[nH]c2ccccc12
MolPort-001-887-704	0.62	COc1ccc(cc1)C(=O)NCCc1c[nH]c2ccccc12
MolPort-001-729-447	0.62	C=CCNC(=O)C(=O)c1c[nH]c2ccccc12
MolPort-046-640-468	0.62	Cc1cccc2c(CC(=O)NC(C)(C)C=CC(O)=O)c[nH]c12
MolPort-001-736-435	0.62	COc1ccc2[nH]cc(CCNC(=O)c3c(OC)cccc3OC)c2c1
MolPort-002-953-339	0.62	COc1cc(OC)c(cc1\C=C(/C#N)C(=O)NCCc1c[nH]c2ccccc12)[N+]([O-])=O
MolPort-044-261-387	0.62	Fc1ccc(CCNC(=O)C=Cc2ccncc2)cc1
MolPort-002-223-861	0.62	COc1ccc(\C=C\C(=O)NCCc2ccc(Cl)cc2)cc1
MolPort-020-165-918	0.62	ClCC(=O)NCC(c1c[nH]c2ccccc12)c1ccccc1
MolPort-002-164-068	0.62	COc1ccc(CCNC(=O)\C=C\c2ccc(Cl)cc2)cc1
MolPort-006-805-326	0.62	COc1ccc2n(CC(=O)NCCc3c[nH]c4ccccc34)ccc2c1
MolPort-009-010-000	0.62	COc1ccc(CCNC(=O)Cc2cn(C)c3ccccc23)cc1
MolPort-002-558-179	0.62	Cc1c(C(=O)CN2CCN(C\C=C\c3ccccc3)CC2)c2ccccc2n1C
MolPort-044-205-380	0.62	CC(N1CCN(CC=Cc2ccccc2)CC1)C(=O)c1c(C)[nH]c2ccccc12
MolPort-002-966-635	0.62	Cc1ccc(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)o1
MolPort-001-973-144	0.62	CC(Cc1c[nH]c2ccccc12)NC(C)=O
MolPort-005-687-940	0.62	CC(C)(C)CC(=O)NCCc1c[nH]c2ccccc12
MolPort-023-282-813	0.62	Cl.NCCC(=O)NCCc1c[nH]c2ccccc12
MolPort-002-768-606	0.62	CCCC(=O)NCCc1c[nH]c2ccccc12
MolPort-003-252-212	0.62	Cc1ccc(CC(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-002-020-711	0.62	COc1ccc2[nH]cc(CCNC(=O)c3ccc(F)cc3)c2c1
MolPort-001-736-432	0.62	COc1ccc2[nH]cc(CCNC(=O)c3ccccc3Br)c2c1
MolPort-006-382-294	0.62	Cc1ccc(CC(=O)NCCc2c[nH]c3ccc(C)cc23)cc1
MolPort-000-720-969	0.62	CC(=O)NCCc1c[nH]c2ccc(Cl)cc12
MolPort-046-594-226	0.62	COc1cc(C=CC(=O)NCCc2ccc(O)cc2)ccc1O
MolPort-009-323-656	0.62	COc1ccc(cc1)C1=CCN(CC1)C(=O)CCc1c[nH]c2ccccc12
MolPort-001-740-847	0.62	COc1cc(\C=C\C(=O)NCCc2ccc(O)cc2)ccc1O
MolPort-035-945-074	0.62	Cl.CCCNCCc1c[nH]c2ccc(OCC)cc12
MolPort-006-783-343	0.62	COc1ccc(CCNC(=O)C(=C\c2ccc(OC)cc2)\c2ccccc2)cc1
MolPort-002-946-719	0.62	COc1cc(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)cc(Cl)c1OCc1ccccc1F
MolPort-001-729-625	0.62	O=C(N1CCC(=CC1)c1ccccc1)C(=O)c1c[nH]c2ccccc12
MolPort-005-603-011	0.62	COc1cc2ccccc2cc1C(=O)NCCc1c[nH]c2ccccc12
MolPort-009-252-408	0.62	COc1ccccc1C(=O)NCCc1c[nH]c2ccccc12
MolPort-002-888-065	0.62	[O-][N+](=O)c1cc(C=CC(=O)NCCc2c[nH]c3ccccc23)ccc1Sc1ccc(Cl)cc1
MolPort-000-739-967	0.62	CSc1ccc(\C=C(/NC(=O)c2ccc(C)cc2)C(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-002-217-271	0.62	CSc1ccc(\C=C(\NC(=O)c2ccc(C)cc2)C(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-002-639-098	0.62	Cn1c2ccc(\C=C(/C#N)C(=O)NCCc3c[nH]c4ccccc34)cc2n(C)c1=O
MolPort-002-714-936	0.62	COc1ccccc1C(=O)N\C(=C/c1ccccc1)C(=O)NCCc1c(C)[nH]c2ccccc12
MolPort-044-291-484	0.62	CN1CCCc2cc(C=CC(=O)NCCc3cccnc3)ccc12
MolPort-002-714-952	0.62	Cc1[nH]c2ccccc2c1CCNC(=O)C(\NC(=O)c1ccccc1)=C\c1ccc(Br)cc1
MolPort-002-744-472	0.62	COc1ccc2[nH]c(C)c(CCNC(=O)C(F)(F)F)c2c1
MolPort-001-736-502	0.62	COc1ccc2[nH]cc(CCNC(=O)CCC3CCCCC3)c2c1
MolPort-039-342-923	0.62	COc1ccc2[nH]cc(CCNC(=O)C34CC5CC(CC(C5)C3)C4)c2c1
MolPort-046-594-034	0.62	COc1ccc2[nH]cc(C(=O)C(=O)N(C(C)C)C(C)C)c2c1
MolPort-001-736-488	0.62	COc1ccc2[nH]cc(CCNC(=O)C3CCCCC3)c2c1
MolPort-001-736-444	0.62	COc1ccc2[nH]cc(CCNC(=O)c3ccc(C)c(C)c3)c2c1
MolPort-027-816-916	0.62	O=C1CCC2(CCN(C\C=C\c3ccccc3)CC2)CN1CCc1cccnc1
MolPort-002-722-695	0.62	COc1ccc(\C=C(/NC(=O)c2ccccc2Cl)C(=O)NCCc2c(C)[nH]c3ccccc23)cc1
MolPort-005-917-403	0.62	O=C(CCCc1c[nH]c2ccccc12)N1CCN(CC1)C(=O)\C=C\c1ccccc1
MolPort-044-378-573	0.62	COc1ccc2[nH]cc(C3=CCN(CC3)C(=O)C=C)c2c1
MolPort-002-722-883	0.62	COc1ccc(\C=C(/NC(=O)c2ccccc2OC)C(=O)NCCc2c(C)[nH]c3ccccc23)cc1
MolPort-028-292-410	0.62	COc1ccccc1CC(C)N(C)C(=O)C=Cc1cccnc1
MolPort-046-594-034	0.62	COc1ccc2[nH]cc(C(=O)C(=O)N(C(C)C)C(C)C)c2c1
MolPort-044-209-553	0.62	CCOc1c(Cl)cc(C=CC(=O)NC(Cc2c[nH]c3ccccc23)C(=O)OC)cc1OC
MolPort-044-416-893	0.62	COC(=O)Cn1cc(C=C(C#N)C(=O)NCCc2c[nH]c3ccccc23)c2ccccc12
MolPort-038-936-247	0.62	O=C(NCCc1cncnc1)\C=C\c1ccccc1
MolPort-045-901-226	0.62	Cl.COc1ccc2[nH]cc(CCNCCS)c2c1
MolPort-028-745-471	0.62	CN1C(=O)C(Br)=C(C1=O)c1c[nH]c2ccccc12
MolPort-020-017-114	0.62	CC(CNC(=O)Cc1c[nH]c2ccccc12)c1ccccc1
MolPort-020-180-732	0.62	CC(=O)N\C(=C/c1ccccc1)C(=O)NC(Cc1c[nH]c2ccccc12)C(O)=O
MolPort-020-136-801	0.62	O=C(NC1CCN(CCc2ccncc2)CC1)C=Cc1ccccc1
MolPort-028-611-196	0.62	Cn1cc(C(O)CNC(=O)\C=C\c2ccsc2)c2ccccc12
MolPort-044-222-770	0.62	Cn1cc(cn1)C(C)(O)CNC(=O)C=Cc1ccnc2ccccc12
MolPort-035-945-074	0.62	Cl.CCCNCCc1c[nH]c2ccc(OCC)cc12
MolPort-046-594-226	0.62	COc1cc(C=CC(=O)NCCc2ccc(O)cc2)ccc1O
MolPort-044-291-484	0.62	CN1CCCc2cc(C=CC(=O)NCCc3cccnc3)ccc12
MCULE-4366689225	0.62	C1(=C(OC)C(=C2C(C(O)C(C)OC(=O)C3C(C(O)C(C)OC2=O)=C(O)C(O)=C(OC)C=3O)=C1)O)O
MolPort-039-342-923	0.62	COc1ccc2[nH]cc(CCNC(=O)C34CC5CC(CC(C5)C3)C4)c2c1
MCULE-9260449258	0.62	C1(O)C(OC)=C2O[C@H](C3C=CC=CC=3OC)CC(=O)C2=C(OC)C=1
MolPort-044-240-155	0.62	COc1ccc(CCNC(=O)C=Cc2cccc(OC)c2)cc1
MCULE-7258052902	0.62	C1(OC)C=C2O[C@@H](C3C=CC=CC=3)CC(=O)C2=C(O)C=1
MolPort-027-816-916	0.62	O=C1CCC2(CCN(C\C=C\c3ccccc3)CC2)CN1CCc1cccnc1
MCULE-3140585141	0.62	C12=C(O)C=C(C=C1OC(CC2=O)(C)C)OCC1=CC=C(C=C1)C(OC)=O
MolPort-044-378-573	0.62	COc1ccc2[nH]cc(C3=CCN(CC3)C(=O)C=C)c2c1
MCULE-4906787678	0.62	C1(C(=C2C(C(O[C@@]3([H])[C@@]2([H])O[C@H](CO)[C@@H](O)[C@@H]3O)=O)=CC=1O)O)OC
MolPort-029-906-793	0.62	Cl.CCNCC(=O)NCCc1c[nH]c2ccccc12
MCULE-8739063782	0.62	C1(O)C(C/C=C(\C)/C)=C2O[C@H](C3C=CC(OC)=C(O)C=3)CC(=O)C2=C(O)C=1
MolPort-019-647-761	0.62	O=C(NCC1(CC1)c1ccccc1)C=Cc1cccnc1
MCULE-7214504893	0.62	COC1=CC(COC(C2OC3=C(C=CC=C3)C2)=O)=CC=C1
MolPort-002-714-942	0.62	COc1ccc(cc1)C(=O)N\C(=C/c1ccc(Cl)cc1)C(=O)NCCc1c(C)[nH]c2ccccc12
MCULE-2855478624	0.62	C1(O)C=C2O[C@H](C3C=CC(OC)=CC=3)CC(=O)C2=C(OC)C=1
MolPort-028-292-410	0.62	COc1ccccc1CC(C)N(C)C(=O)C=Cc1cccnc1
MCULE-2163904316	0.62	C1(O)C=C2C(C(CC(C3=CC(OC)=C(O)C=C3)O2)=O)=C(C=1C/C=C(\C)/C)O
MolPort-028-912-965	0.62	Cl.CCOc1ccc2[nH]cc(CCNC(C)C)c2c1
MCULE-9912319515	0.62	C1C=C2C(O[C@]3([H])COC4C=C(OC)C(OC)=CC=4[C@]3(O)C2=O)=CC=1OC
MolPort-044-255-638	0.62	FC(F)Oc1ccc(CCNC(=O)C=Cc2ccc(OC(F)F)cc2)cc1
MCULE-8810069198	0.62	C12C(OC(C)=O)=CC(=CC=1OC(CC2=O)C1C=CC(=C(OCC2C=CC=CC=2)C=1)OCC1C=CC=CC=1)OC(C)=O
MolPort-028-912-965	0.62	Cl.CCOc1ccc2[nH]cc(CCNC(C)C)c2c1
MCULE-8604836333	0.62	C12OC(C)(C)CCC1=C1O[C@H](C3C=CC=CC=3)CC(=O)C1=C(O)C=2
MolPort-023-282-813	0.62	Cl.NCCC(=O)NCCc1c[nH]c2ccccc12
MCULE-9623787489	0.62	CCC1=CC=C(C(C(OC(C2=CC3=C(OCCO3)C(OC)=C2)=O)C)=O)C=C1
MolPort-020-165-918	0.62	ClCC(=O)NCC(c1c[nH]c2ccccc12)c1ccccc1
MCULE-4038156022	0.62	CCC1=CC=C(C(COC(C2=CC=C(OCC3OCCC3)C=C2)=O)=O)C=C1
MolPort-044-261-387	0.62	Fc1ccc(CCNC(=O)C=Cc2ccncc2)cc1
MCULE-6601523557	0.62	OC1=CC(O)=C(C(COC(C2=C3C(OCCO3)=CC=C2)=O)=O)C=C1
MolPort-044-205-380	0.62	CC(N1CCN(CC=Cc2ccccc2)CC1)C(=O)c1c(C)[nH]c2ccccc12
MCULE-1243164622	0.62	C12C=C(OC)C=CC=1OC(C1=CC=C(OC)C=C1)CC2=O
MolPort-046-640-468	0.62	Cc1cccc2c(CC(=O)NC(C)(C)C=CC(O)=O)c[nH]c12
MCULE-5052743999	0.62	O=C1C2C(=CC(=CC=2OC(C2C=CC=CC=2)C1)OC)O
MCULE-2058902056	0.62	COC1=C(OC)C(OC)=CC(C(OCC(C2=CC3=C(OCCO3)C=C2)=O)=O)=C1
MCULE-2337043419	0.62	C12C=C(C=CC=1C(CC(C1=CC=CC=C1)O2)=O)O
MCULE-7797086388	0.62	O1C2C=CC=CC=2C(CC1C1C=CC(=C(OC)C=1)OC)=O
MolPort-044-414-328	0.61	Cc1ccc(cc1)C(=O)NC(=Cc1cccnc1)C(=O)NCCc1c[nH]c2ccccc12
MolPort-000-708-915	0.61	Cc1ccc(cc1)C(=O)N\C(=C\c1cccnc1)C(=O)NCCc1c[nH]c2ccccc12
MolPort-002-768-932	0.61	COc1ccc2[nH]cc(CCNC(=O)C(C)OC(C)=O)c2c1
MolPort-029-925-660	0.61	NC(=O)C(Cc1ccccc1)NC(=O)C=Cc1ccnc2ccccc12
MolPort-019-909-779	0.61	COc1ccc2[nH]cc(CCNC(=O)Cn3ccc4c(OC)cccc34)c2c1
MolPort-001-736-494	0.61	COc1ccc2[nH]cc(CCNC(=O)CCCOc3ccccc3)c2c1
MolPort-028-270-487	0.61	COc1ccc2[nH]cc(CCNC(=O)C=Cc3csc(C)n3)c2c1
MolPort-002-768-247	0.61	COc1ccc(cc1)C(=O)NCCc1c[nH]c2ccc(C)cc12
MolPort-046-728-665	0.61	Cc1[nH]c2ccc(F)cc2c1CCNC(=O)C=C
MolPort-009-149-123	0.61	COc1cc(OC)c(C2=CCN(CC2)C(C)C(=O)c2c[nH]c3ccccc23)c(OC)c1
MolPort-002-933-838	0.61	CC(Cc1c[nH]c2ccccc12)NC(=O)CCl
MolPort-003-033-020	0.61	COc1ccc(OC)c2[nH]c(=O)c(CCNC(=O)\C=C/c3ccc4OCOc4c3)cc12
MolPort-001-838-301	0.61	COc1ccc(\C=C\C(=O)NCCc2ccc(OC)c(OC)c2)cc1
MolPort-000-375-130	0.61	COc1ccc(CCNC(=O)\C=C\c2ccc(OC)c(OC)c2)cc1
MolPort-044-260-916	0.61	CC(C)C(NC(=O)C=Cc1ccnc2ccccc12)C#N
MolPort-004-169-069	0.61	Clc1cccc(CCNC(=O)Cc2c[nH]c3ccccc23)c1
MolPort-000-849-686	0.61	O=C(NCCc1c[nH]c2ccccc12)c1ccc2[nH]ccc2c1
MolPort-004-097-905	0.61	COc1ccccc1CC(=O)NCCc1c[nH]c2ccccc12
MolPort-044-261-246	0.61	COc1ccc(cc1)C(CNC(=O)C=Cc1ccc2cc(OC)ccc2c1)N(C)C
MolPort-044-408-777	0.61	CCC(C)NC(=O)C=Cc1ccc(OCc2ccncc2)cc1
MolPort-044-383-630	0.61	CCC(C)(C)NC(=O)C=Cc1ccc(OCc2ccncc2)cc1
MolPort-003-360-528	0.61	COc1ccc(CCNC(=O)C(=O)NCCc2c[nH]c3ccccc23)cc1OC
MolPort-006-753-929	0.61	FC(F)(F)Oc1ccc(cc1)C(=O)NCCc1c[nH]c2ccccc12
MolPort-005-582-631	0.61	COc1ccc(C(=O)NCCc2c[nH]c3ccccc23)c(O)c1
MolPort-000-814-533	0.61	COc1ccc(cc1)C(=O)NCCc1c[nH]c2cc(OC)ccc12
MolPort-002-987-270	0.61	CCC(C)NC(=O)C(=O)NCCc1c[nH]c2ccccc12
MolPort-001-491-445	0.61	COc1ccc(CCNC(=O)\C=C\c2ccc(cc2)[N+]([O-])=O)cc1
MolPort-000-666-065	0.61	CCCOc1ccc(\C=C\C(=O)NCCc2ccccc2)cc1
MolPort-046-777-589	0.61	COc1ccc2[nH]cc(CCNC(=O)Cc3cc(C)nc(C)c3)c2c1
MolPort-001-736-402	0.61	CC(C)NCC(O)COc1ccc2[nH]cc(CCNC(C)=O)c2c1
MolPort-002-768-746	0.61	COc1ccc2[nH]cc(CCNC(=O)c3ccc(cc3)C(F)(F)F)c2c1
MolPort-001-736-157	0.61	COc1ccc2[nH]cc(CCNC(=O)C(\NC(=O)c3ccc(C)cc3)=C\c3cn(C)c4ccccc34)c2c1
MolPort-001-736-154	0.61	CCn1cc(\C=C(/NC(=O)c2ccccc2)C(=O)NCCc2c[nH]c3ccc(OC)cc23)c2ccccc12
MolPort-009-259-378	0.61	O=C(NCC1CCCc2ccccc12)C=Cc1cccc2cccnc12
MolPort-002-223-350	0.61	COc1ccc(\C=C(\C(=O)NCc2cccnc2)c2ccccc2)cc1
MolPort-003-002-599	0.61	CC(C)CC(=O)NCCc1c[nH]c2ccc(C)cc12
MolPort-006-754-371	0.61	COCC(=O)NCCc1c[nH]c2ccccc12
MCULE-9445997056	0.61	O1C2=CC(=CC=C2O[C@H](CO)[C@H]1C1=CC=C(C(OC)=C1)OC)C=O
MolPort-000-815-155	0.61	CCC(C)C(=O)NCCc1c[nH]c2ccc(C)cc12
MCULE-7439794905	0.61	C12C=C(OC)C=CC=1O[C@](CC2=O)([H])C1=CC=CC=C1
MolPort-005-693-396	0.61	COc1ccc(CC(=O)NCCc2cccc3cccnc23)cc1
MCULE-1896760231	0.61	C12=CC(OCC(OCC)=O)=CC(O)=C1CCC(C)(C)O2
MolPort-006-783-013	0.61	COc1ccc(\C=C(\C(=O)NCCc2ccccc2)c2ccccc2)cc1
MCULE-8672720315	0.61	COC1=CC(C(OCCOC2=C(C(C)=O)C=CC=C2)=O)=CC(OC)=C1
MolPort-039-002-167	0.61	CCN(C)C(=O)C(C)NC(=O)Cc1c[nH]c2ccc(OC)cc12
MCULE-6359355499	0.61	C12C=C(OC)C=CC=1O[C@@](CC2=O)([H])C1C=CC2=C(OCCCCO2)C=1
MolPort-044-278-326	0.61	CCOc1cc(C=CC(=O)NCC(c2cccs2)c2c[nH]c3ccccc23)ccc1OCC(C)C
MCULE-2186233234	0.61	COC1=CC(C(COC(C2=CC(OC)=C(OC)C(OC)=C2)=O)=O)=C(OC)C=C1
MolPort-009-032-137	0.61	CN(C)c1ccc(cc1)C(CNC(C)=O)c1c[nH]c2ccccc12
MCULE-8651766025	0.61	COC1=C(COC(C2OC3=C(C=CC=C3)C2)=O)C=C(C(C)=O)C=C1
MolPort-004-188-815	0.61	CC(CNC(=O)Cc1c[nH]c2ccccc12)(c1ccccc1)c1ccccc1
MCULE-4437868251	0.61	C1(OC2OC(C)C(C(O)C2O)O)C(O)C(O)C(OC1OC1=CC(O)=C2C(OC(CC2=O)C2=CC=C(C(O)=C2)OC)=C1)CO
MolPort-002-715-420	0.61	CC(Cc1c[nH]c2ccccc12)NC(=O)CN
MCULE-3625538935	0.61	C12C=C(OC)C=CC=1OC(CC2=O)C1=CC=CC=C1
MolPort-002-020-726	0.61	CCC(=O)NCCc1c[nH]c2ccc(Cl)cc12
MCULE-8847245497	0.61	C1C(C(C2C(C3=CC(OC)=CC(OC)=C3)O2)=O)=CC=C(OC)C=1
MolPort-004-192-979	0.61	O=C(Cc1c[nH]c2ccccc12)NCC(c1ccccc1)c1ccccc1
MCULE-3620823687	0.61	CC(C(C1=CC=CC=C1)=O)OC(C1=CC2=C(OCCO2)C=C1)=O
MolPort-044-225-258	0.61	CC1CN(CCN1)C(=O)C=Cc1cccc2cccnc12
MCULE-2806261435	0.61	CC(C1=C(OCCOC(C2=CC(O)=CC=C2)=O)C=CC=C1)=O
MolPort-039-316-485	0.61	FC(F)(F)CC(=O)NCCc1c[nH]c2ccc(Br)cc12
MCULE-5820672663	0.61	C12CC3(O)C(C)(OC1=CC(O)=C1C(=O)OC(C)C(C=21)OC(C)=O)CCC1(C(C)C)OC(=O)CCC31C
MolPort-044-292-065	0.61	Cc1nn(C)c(C)c1CCNC(=O)C=Cc1cccc2cccnc12
MCULE-7233709477	0.61	C12C(=O)CC(OC=1C(=C(O)C(C)=C2O)C=O)C1=CC=CC=C1
MolPort-005-909-702	0.61	COc1ccc(CCNC(=O)Cc2c[nH]c3ccccc23)cc1OC
MCULE-4132938823	0.61	C1C(O)=C2CC(O)C(C3C=CC(O)=CC=3)OC2=C2C3(OC4C=C(O)C(C5C(O)C(O)C(O)C(CO)O5)=C(O)C=4C3=O)C(C3C=CC(O)=CC=3)OC=12
MolPort-001-513-620	0.61	COc1ccc(OCC(=O)NCCc2c[nH]c3ccccc23)cc1
MCULE-9394594265	0.61	COC1=CC(OC)=C(C(COC(C2=CC(OC)=C(OC)C=C2)=O)=O)C(OC)=C1
MolPort-004-103-941	0.61	CCOc1ccc(OCC(=O)NCCc2c[nH]c3ccccc23)cc1
MCULE-7448502380	0.61	[C@@H]1(O[C@@H]2O[C@@H](C)[C@@H]([C@@H](O)[C@H]2O)O)[C@@H](O)[C@H](O)[C@H](O[C@H]1OC1C=C(O)C2=C(O[C@@H](CC2=O)C2C=CC(=C(O)C=2)OC)C=1)CO
MolPort-001-729-578	0.61	COc1ccc(CCNC(=O)C(=O)c2c[nH]c3ccccc23)cc1
MCULE-9783608964	0.61	CC(C(C1=CC(C)=C(C)C=C1)=O)OC(C1=CC2=C(OCCO2)C=C1)=O
MolPort-005-558-103	0.61	COc1ccc(C)cc1C(=O)NCCc1c[nH]c2ccccc12
MCULE-7268905540	0.61	C12=C(C)C=C(C=C1C(CC(C1=CC=C(C(OC)=C1)OC)O2)=O)C
MolPort-000-147-789	0.61	CC(=O)NCCc1c(C)[nH]c2ccccc12
MCULE-3980393912	0.61	C1(C)(CC(C)(C)C2=C(C=C(C=C2)O)O1)C1=CC=C(C=C1O)O
MolPort-044-562-604	0.61	COc1ccc2n(CCC(=O)NCCc3cn(C)c4ccccc34)ccc2c1
MCULE-9522158167	0.61	C1(O)C=C2O[C@H](C3C=CC(O)=C(O[C@H]4[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O4)C=3)[C@@H](O)C(=O)C2=C(O)C=1
MolPort-027-563-981	0.61	COc1ccc(CCNC(=O)Cc2cn(C(C)C)c3ccccc23)cc1
MCULE-7698696665	0.61	COC1=CC(C(COC(C2=C(OCC3OCCC3)C=CC=C2)=O)=O)=CC=C1
MolPort-002-714-953	0.61	Cc1[nH]c2ccccc2c1CCNC(=O)C(\NC(=O)c1ccccc1Br)=C\c1ccccc1
MCULE-6209828622	0.61	C12C=C(OC)C=CC=1OC(CC2=O)C1C=CC2=C(OCCCCO2)C=1
MolPort-044-728-798	0.61	CN(CC(O)c1ccc(O)cc1)C(=O)Cc1cn(C)c2ccccc12
MCULE-4866223969	0.61	COC1=C2C(OCCO2)=CC(C(OCC(C2=CC=CC=C2)=O)=O)=C1
MolPort-021-745-974	0.61	COc1ccc2[nH]cc(CCNC(=O)CCn3ccc4c(OC)cccc34)c2c1
MCULE-2180505212	0.61	COC1=CC(OC)=C(C(COC(COC2=C(C)C=CC(C)=C2)=O)=O)C=C1
MolPort-028-270-529	0.61	COc1ccc2[nH]cc(CCNC(=O)CCN3CCCC3=O)c2c1
MCULE-6879190021	0.61	CC1=CC(C(COC(C2=CC=C(OCC3OCCC3)C=C2)=O)=O)=C(C)C=C1
MolPort-001-736-438	0.61	COc1ccc2[nH]cc(CCNC(=O)c3cccc(Cl)c3)c2c1
MCULE-9412696724	0.61	C12C(OC(C)=O)=C(OC)C(=CC=1C(=O)OC1C(C(OC(C)=O)C(COC(C)=O)OC12)OC(C)=O)OC(C)=O
MolPort-001-736-448	0.61	COc1ccc2[nH]cc(CCNC(=O)c3ccc(cc3)-c3ccccc3)c2c1
MCULE-8668026796	0.61	C1(O)=C(OC)C=C(C=C1OC)C(=O)OCC(=O)C1=CC=CC=C1OC
MolPort-028-364-214	0.61	COc1ccc(\C=C\C(=O)NCCc2ccccn2)cc1OC
MCULE-5830685626	0.61	C1(OC)C=C2O[C@H](C3C=CC(O)=CC=3)CCC2=CC=1
MolPort-001-534-284	0.61	Cc1[nH]c2ccccc2c1\C=C(/C#N)C(=O)NCCc1ccccc1
MCULE-2164850243	0.61	O=C(C1=CC2=C(OCO2)C=C1)COC(C1=CC=C(OCC2OCCC2)C=C1)=O
MolPort-028-291-573	0.61	CN(CCc1ccccn1)C(=O)C=Cc1cn(C)c2ccccc12
MCULE-8969680562	0.61	O1C2=CC(=CC=C2C(C2C(=C(C(CCCCCCCCCCC)=O)C(=C(C(CCCCCCCCCCC)=O)C=2O)O)O)CC1C1=CC=C(C=C1)O)O
MolPort-009-509-873	0.61	CCN(CC)C(=O)Cc1c[nH]c2ccccc12
MCULE-5422413755	0.61	CC1=CC(C)=C(C(COC(C2=CC=C(OCC3OCCC3)C=C2)=O)=O)C=C1
MolPort-009-049-044	0.61	COc1ccc2[nH]cc(C3=CCN(CC3)C(=O)CCc3ccccc3)c2c1
MCULE-9416015572	0.61	C(C1=CC=CC=C1)(=O)C(C1C=CC=CC=1)OC(COC1=CC=CC=C1C)=O
MolPort-002-921-598	0.61	FC(F)(F)C(=O)NCC(c1c[nH]c2ccccc12)c1ccccc1
MCULE-1554429196	0.61	C1(C(O)=O)C=C2[C@H](CO)[C@@H](C3C=C(OC)C(O)=CC=3)OC2=C(OC)C=1
MolPort-028-275-869	0.61	CC(C)N(C)CCCCNC(=O)C=Cc1ccnc2ccccc12
MCULE-9435481307	0.61	C1(=C2CC(O)C(C)(C)OC2=C(C(=O)O)C(=C1)CCCCC)OC
MolPort-020-055-576	0.61	O=C(C=Cc1ccnc2ccccc12)N(CCC#N)CCC#N
MCULE-9384192043	0.61	C1(OC)C=C(C(=O)OC)C=CC=1OC(C(C1C=C(OC)C(O)=CC=1)O)CO
MolPort-019-641-097	0.61	COc1ccc(C=CC(=O)NCCc2ccc(F)cc2)cc1
MCULE-1523399872	0.61	C1(O)C(CC(C/C=C(\C)/C)C(C)=C)=C2O[C@H](C3C(O)=CC(O)=CC=3)[C@@H](O)C(=O)C2=C(O)C=1
MolPort-000-912-051	0.61	CCC(CC)C(=O)NCCc1c[nH]c2ccc(C)cc12
MCULE-8451832710	0.61	C1=C(O)C=CC(CCC(=O)C2C(O)=CC(O[C@@H]3O[C@H](COC(=O)C4C=C(O)C(O)=C(O)C=4)[C@@H](O)[C@H](O)[C@H]3O)=CC=2O)=C1
MolPort-002-102-681	0.61	Clc1ccc(CC(=O)NCCc2c[nH]c3ccccc23)cc1
MCULE-4044377173	0.61	C1(O[C@H]2[C@H](O[C@H]3[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O3)[C@@H](O)[C@H](O)[C@@H](CO)O2)C=C2O[C@H](C3C=CC(OC)=C(O)C=3)CC(=O)C2=C(O)C=1
MolPort-002-223-161	0.61	COc1ccc(\C=C\C(=O)NCCc2ccc(F)cc2)cc1
MCULE-1157112040	0.61	OC1=C(C=C([C@@H]2OC3=CC(=CC(=C3C(=O)[C@H]2O)O)O)C=C1)O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O1
MolPort-002-280-950	0.61	Cl.CC(Cc1c[nH]c2ccccc12)NC(=O)CN
MCULE-7787580677	0.61	C1(OCCCCCCCC)=CC=C(C=C1)C(=O)OC1=CC=C(O)C(C(=O)OCCOC2C=CC(C(=O)CCCCCCCC)=CC=2)=C1
MolPort-005-787-145	0.61	O=C(CN1CCN(CC(=O)NC2CC2)CC1)NCCc1c[nH]c2ccccc12
MCULE-4432206889	0.61	C1(OC)C(OC(=O)C)=C2[C@@]3(O[C@H](COC(=O)C)[C@@H](OC(=O)C)[C@H](OC(=O)C)[C@]3(OC(=O)C2=CC=1OC(=O)C)[H])[H]
MolPort-001-959-583	0.61	COc1ccc(CCNC(=O)\C=C\c2ccccc2OC)cc1
MCULE-5717525103	0.61	C12OC(C)(C)CC(=O)C1=CC=C(OCC1C=CC=C3C=CC=CC=13)C=2C
MolPort-001-490-336	0.61	COc1ccc(CCNC(=O)\C=C\c2ccc(F)cc2)cc1
MCULE-4058220272	0.61	O([C@H]1[C@H](O)[C@H](O)[C@H]([C@H](C)O1)O)[C@@H]1[C@H]([C@@H]([C@@H](CO)O[C@H]1OC1C=C2O[C@H](C3C=CC(O)=C(O)C=3)CC(=O)C2=C(O)C=1)O)O
MolPort-002-146-713	0.61	CCC(Cc1ccccc1)NC(=O)\C=C\c1ccc(OC)cc1
MCULE-7275500281	0.61	C1(OC)C=C2OC(CC(C2=C(OC)C=1)=O)C1C=CC=CC=1
MolPort-044-225-351	0.61	CC1CN(CC(C)N1)C(=O)C=Cc1cccc2cccnc12
MCULE-5610701629	0.61	C1(C(=O)OC)C=C2[C@H](CO)[C@@H](C3C=C(OC)C(O)=CC=3)OC2=C(OC)C=1
MolPort-002-509-206	0.61	COc1ccc2[nH]cc(CCNCCNCCS)c2c1
MCULE-6644566955	0.61	C1(O)C=C2OC[C@@]3([H])C4C=CC(O)=C(CCC(O)(C)C)C=4O[C@@]3([H])C2=CC=1
MolPort-039-316-525	0.61	COCC(C)C(=O)NCCc1c[nH]c2ccc(Br)cc12
MCULE-2181940319	0.61	C1(=CC=C(OC)C(=C1)OC)C(OC(=O)C)C(C)OC1=C(OC)C=C(CC=C)C=C1OC
MolPort-000-515-971	0.61	CCNC(=O)NCCc1c[nH]c2cc(OC)ccc12
MCULE-8933677756	0.61	C1(O)C(C[C@@H](CCC(O)(C)C)C(C)=C)=C2O[C@H](C3C(O)=CC(O)=CC=3)[C@H](O)C(=O)C2=C(OC)C=1
MolPort-001-981-742	0.61	Brc1ccc(\C=C(\C#N)C(=O)NCCc2c[nH]c3ccccc23)s1
MCULE-9332914030	0.61	C12C=C(OC)C=CC=1C(CC(C1C=CC=CC=1)O2)=O
MolPort-002-722-704	0.61	Cc1[nH]c2ccccc2c1CCNC(=O)C(\NC(=O)c1ccc(C)cc1)=C\c1ccc(Cl)cc1
MCULE-6888108556	0.61	C1(OC2C(O)C(O)C(CO)O2)C=C2OC(C3C=CC(O)=CC=3)C(O)CC2=C(O)C=1
MolPort-002-332-703	0.61	Brc1ccc(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)s1
MCULE-6062655870	0.61	C1(O)C(C/C=C(\C)/C)=C2O[C@H](C3C(O)=CC(O)=C(OC)C=3)CC(=O)C2=C(O)C=1
MolPort-022-377-236	0.61	CNCCc1c[nH]c2cccc(O)c12
MCULE-9197350217	0.61	C1(O)C=C2O[C@H](C3C(O)=CC=CC=3O)CC(=O)C2=C(O)C=1
MolPort-004-896-869	0.61	COc1ccc(cc1)C(CNC(=O)c1ccc(OC)cc1)c1c[nH]c2ccccc12
MCULE-1040954793	0.61	O1C2C=CC=CC=2C(CC1C1C=CC=C(O)C=1)=O
MolPort-004-896-866	0.61	COc1ccc(cc1)C(CNC(=O)c1ccc(C)cc1)c1c[nH]c2ccccc12
MCULE-3334832041	0.61	C12C=C(OC)C=CC=1C(CC(C1C=CC=C(OC)C=1OC)O2)=O
MolPort-000-816-266	0.61	COc1ccc2c(CCNC(=O)c3ccccc3OC)c[nH]c2c1
MolPort-000-818-175	0.61	COc1ccccc1C(=O)NCCc1c[nH]c2ccc(C)cc12
MolPort-002-175-105	0.61	[O-][N+](=O)c1ccc(\C=C(/NC(=O)c2ccccc2)C(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-006-385-372	0.61	Brc1ccc(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)o1
MolPort-001-736-500	0.61	COc1ccc2[nH]cc(CCNC(=O)CSCc3ccccc3)c2c1
MolPort-002-722-700	0.61	COc1ccccc1C(=O)N\C(=C/c1ccc(Cl)cc1)C(=O)NCCc1c(C)[nH]c2ccccc12
MolPort-001-759-350	0.61	ClCCC(=O)NCCc1c[nH]c2ccccc12
MolPort-002-863-374	0.61	CC(C)(CCl)C(=O)NCCc1c[nH]c2ccccc12
MolPort-001-973-143	0.61	CC(=O)NCCc1c[nH]c2ccc(F)cc12
MolPort-044-600-448	0.61	O=C1CCCN1CCc1c[nH]c2ccccc12
MolPort-000-160-282	0.61	O=C(NCCc1c[nH]c2ccccc12)c1ccccc1
MolPort-002-535-994	0.61	COc1ccc2[nH]cc(\C=C3/C(=O)NC(=O)N(CCc4ccc(OC)c(OC)c4)C3=O)c2c1
MolPort-019-676-261	0.61	CC(C)CC(=O)NCCc1c[nH]c2cc(C)ccc12
MolPort-003-789-760	0.61	NCCCC(=O)NCCc1c[nH]c2ccccc12
MolPort-020-231-208	0.61	O=C(N1CC(C1)c1cccnc1)C1=Cc2ccccc2OC=C1
MolPort-002-866-305	0.61	CC(C)CCN(CCC(C)C)C(=O)\C=C\c1cnc2ccccc2c1
MolPort-002-884-973	0.61	CCOc1ccc(\C=C\C(=O)NCCc2ccc(Cl)cc2)cc1
MolPort-035-842-480	0.61	COc1ccc2[nH]cc(C3=CCN(CC3)C(=O)C(F)=C(C)C)c2c1
MolPort-027-644-381	0.61	COc1ccc(CCNC(=O)CN2CCC(=CC2)c2c[nH]c3ccccc23)cc1
MolPort-044-303-232	0.61	COc1ccc2[nH]cc(C3=CCN(CC3)C(=O)C=C(C)C3CC3)c2c1
MolPort-008-269-474	0.61	COc1ccc2[nH]cc(CCNC(=O)OC(C)(C)C)c2c1
MolPort-004-667-871	0.61	CCOc1ccc(cc1)C(=O)NCCc1c[nH]c2ccccc12
MolPort-020-137-305	0.61	CCCN(Cc1ccccc1O)C(=O)Cc1c[nH]c2ccccc12
MolPort-002-020-608	0.61	COc1ccc2c(CCNC(=O)c3ccc(C)cc3)c[nH]c2c1
MolPort-009-599-493	0.61	COc1ccc(cc1)C(CNC(=O)Cc1ccc(OC)c(OC)c1)c1c[nH]c2ccccc12
MolPort-004-192-848	0.61	COc1ccc(cc1)C(CNC(=O)CN1CCCC1)c1c[nH]c2ccccc12
MolPort-001-736-404	0.61	CC(=O)NCCc1c[nH]c2ccc(OCC(O)CNC(C)(C)C)cc12
MolPort-020-231-208	0.61	O=C(N1CC(C1)c1cccnc1)C1=Cc2ccccc2OC=C1
MolPort-044-272-221	0.61	O=C(C=Cc1cccc2cccnc12)N1CCOC(C1)c1ccccc1
MolPort-028-270-487	0.61	COc1ccc2[nH]cc(CCNC(=O)C=Cc3csc(C)n3)c2c1
MolPort-044-260-916	0.61	CC(C)C(NC(=O)C=Cc1ccnc2ccccc12)C#N
MolPort-044-261-246	0.61	COc1ccc(cc1)C(CNC(=O)C=Cc1ccc2cc(OC)ccc2c1)N(C)C
MolPort-044-383-630	0.61	CCC(C)(C)NC(=O)C=Cc1ccc(OCc2ccncc2)cc1
MolPort-044-408-777	0.61	CCC(C)NC(=O)C=Cc1ccc(OCc2ccncc2)cc1
MolPort-027-563-981	0.61	COc1ccc(CCNC(=O)Cc2cn(C(C)C)c3ccccc23)cc1
MolPort-039-002-167	0.61	CCN(C)C(=O)C(C)NC(=O)Cc1c[nH]c2ccc(OC)cc12
MolPort-044-562-604	0.61	COc1ccc2n(CCC(=O)NCCc3cn(C)c4ccccc34)ccc2c1
MolPort-044-600-448	0.61	O=C1CCCN1CCc1c[nH]c2ccccc12
MolPort-035-842-480	0.61	COc1ccc2[nH]cc(C3=CCN(CC3)C(=O)C(F)=C(C)C)c2c1
MolPort-044-225-351	0.61	CC1CN(CC(C)N1)C(=O)C=Cc1cccc2cccnc12
MolPort-044-303-232	0.61	COc1ccc2[nH]cc(C3=CCN(CC3)C(=O)C=C(C)C3CC3)c2c1
MolPort-027-644-381	0.61	COc1ccc(CCNC(=O)CN2CCC(=CC2)c2c[nH]c3ccccc23)cc1
MolPort-020-137-305	0.61	CCCN(Cc1ccccc1O)C(=O)Cc1c[nH]c2ccccc12
MolPort-003-983-480	0.61	COc1ccc2[nH]c(I)c(CCNC(C)=O)c2c1
MolPort-028-270-529	0.61	COc1ccc2[nH]cc(CCNC(=O)CCN3CCCC3=O)c2c1
MolPort-021-745-974	0.61	COc1ccc2[nH]cc(CCNC(=O)CCn3ccc4c(OC)cccc34)c2c1
MolPort-028-364-214	0.61	COc1ccc(\C=C\C(=O)NCCc2ccccn2)cc1OC
MolPort-028-291-573	0.61	CN(CCc1ccccn1)C(=O)C=Cc1cn(C)c2ccccc12
MolPort-028-275-869	0.61	CC(C)N(C)CCCCNC(=O)C=Cc1ccnc2ccccc12
MolPort-020-055-576	0.61	O=C(C=Cc1ccnc2ccccc12)N(CCC#N)CCC#N
MolPort-044-414-328	0.61	Cc1ccc(cc1)C(=O)NC(=Cc1cccnc1)C(=O)NCCc1c[nH]c2ccccc12
MolPort-029-925-660	0.61	NC(=O)C(Cc1ccccc1)NC(=O)C=Cc1ccnc2ccccc12
MolPort-019-909-779	0.61	COc1ccc2[nH]cc(CCNC(=O)Cn3ccc4c(OC)cccc34)c2c1
MolPort-044-278-326	0.61	CCOc1cc(C=CC(=O)NCC(c2cccs2)c2c[nH]c3ccccc23)ccc1OCC(C)C
MolPort-044-271-361	0.61	COc1ccc2[nH]cc(C3=CCN(CC3)C(=O)C=CCN(C)C)c2c1
MolPort-044-273-324	0.61	COc1ccc(Cl)cc1C=CC(=O)N1CCC(CC1)c1c[nH]c2ccc(cc12)C(N)=O
MolPort-038-968-098	0.61	CCOc1cccc2[nH]cc(CCNC(=O)C(C)C)c12
MolPort-035-841-022	0.61	COc1ccc2[nH]cc(CCNC(=O)N3CC(C)(C)C3(C)C)c2c1
MolPort-020-164-041	0.61	COC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C=Cc1ccccn1
MolPort-045-901-707	0.61	O=C(Cc1c[nH]c2ccccc12)NCCc1c[nH]c2ccc(OCc3ccccc3)cc12
MolPort-046-440-283	0.61	CCC1CCN1C(=O)Cc1c[nH]c2ccc(OC)cc12
MolPort-027-906-167	0.61	CCC(=O)N1CCC(CC1)NCCc1c[nH]c2ccc(OC)cc12
MolPort-019-950-497	0.61	COc1ccc2[nH]cc(CCNC(=O)Cn3ccc4c(C)cccc34)c2c1
MolPort-035-765-711	0.61	CN1CCCC1CCn1cc(C2=C(C(=O)NC2=O)c2c[nH]c3ccccc23)c2ccccc12
MolPort-044-279-152	0.61	CCOc1c(Cl)cc(C=CC(=O)NCCc2c([nH]c3ccccc23)-c2ccc(F)cc2)cc1OC
MolPort-046-766-162	0.61	Cl.[2H]C([2H])(N)C([2H])([2H])c1c[nH]c2ccc(O)cc12
MolPort-046-793-371	0.61	Cl.[15NH2][13CH2][13CH2]c1c[nH]c2ccc(O)cc12
MolPort-042-585-150	0.61	Oc1ccccc1CC(=O)NCCc1c[nH]c2ccc(Cl)cc12
MolPort-046-179-368	0.61	Cc1[nH]c2c(C)c(C)ccc2c1CCNC(=O)\C=C\c1cnc(N)nc1
MolPort-022-377-236	0.61	CNCCc1c[nH]c2cccc(O)c12
MolPort-046-777-589	0.61	COc1ccc2[nH]cc(CCNC(=O)Cc3cc(C)nc(C)c3)c2c1
MolPort-039-316-485	0.61	FC(F)(F)CC(=O)NCCc1c[nH]c2ccc(Br)cc12
MolPort-044-225-258	0.61	CC1CN(CCN1)C(=O)C=Cc1cccc2cccnc12
MolPort-044-292-065	0.61	Cc1nn(C)c(C)c1CCNC(=O)C=Cc1cccc2cccnc12
MolPort-046-728-665	0.61	Cc1[nH]c2ccc(F)cc2c1CCNC(=O)C=C
MolPort-039-316-525	0.61	COCC(C)C(=O)NCCc1c[nH]c2ccc(Br)cc12
MolPort-044-728-798	0.61	CN(CC(O)c1ccc(O)cc1)C(=O)Cc1cn(C)c2ccccc12
MolPort-001-973-145	0.61	CCC(=O)NC(C)Cc1c[nH]c2ccccc12
MolPort-001-682-115	0.61	O=C(CC#N)NCCc1c[nH]c2ccccc12
MolPort-002-714-949	0.61	Cc1[nH]c2ccccc2c1CCNC(=O)C(\NC(=O)c1ccccc1)=C\c1ccc(Cl)cc1
MolPort-002-559-945	0.61	Fc1ccc(\C=C(\NC(=O)c2ccccc2Cl)C(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-020-164-041	0.61	COC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C=Cc1ccccn1
MolPort-001-736-406	0.61	O=C(NCCc1c[nH]c2ccc(OCc3ccccc3)cc12)C1CC1
MolPort-045-901-707	0.61	O=C(Cc1c[nH]c2ccccc12)NCCc1c[nH]c2ccc(OCc3ccccc3)cc12
MolPort-000-511-284	0.61	Cc1ccc2[nH]cc(CCNC(=O)C(c3ccccc3)c3ccccc3)c2c1
MolPort-004-972-735	0.61	COc1ccc2[nH]cc(CCNC(=C3C(=O)N(C)C(=O)N(C)C3=O)c3ccc(C)cc3)c2c1
MolPort-009-063-097	0.61	COc1cccc(CCNC(=O)Cc2c[nH]c3ccccc23)c1
MolPort-027-906-167	0.61	CCC(=O)N1CCC(CC1)NCCc1c[nH]c2ccc(OC)cc12
MolPort-046-440-283	0.61	CCC1CCN1C(=O)Cc1c[nH]c2ccc(OC)cc12
MolPort-002-592-287	0.61	COc1ccc2n(Cc3ccccc3)c(C)c(C(=O)CN3CCN(C\C=C\c4ccccc4)CC3)c2c1
MolPort-001-844-657	0.61	CCN1CCN(CC(=O)c2c[nH]c3ccc(OC)cc23)CC1
MolPort-009-505-521	0.61	CCCCC(=O)NCC(c1c[nH]c2ccccc12)c1ccc(OC)cc1
MolPort-004-213-480	0.61	Oc1ccc(cc1Cl)C(=O)NCCc1c[nH]c2ccccc12
MolPort-001-736-467	0.61	CCOc1ccccc1C(=O)NCCc1c[nH]c2ccc(OC)cc12
MolPort-002-538-811	0.61	CC(C)(C)c1cc(CCC(=O)NCCc2c[nH]c3ccccc23)cc(c1O)C(C)(C)C
MolPort-005-972-426	0.61	COc1ccc2[nH]cc(CCNC(=O)Cn3ccc4cc(Br)ccc34)c2c1
MolPort-002-317-078	0.61	Cl.COc1ccc2[nH]cc(CCNC(=O)c3cccnc3)c2c1
MolPort-019-950-497	0.61	COc1ccc2[nH]cc(CCNC(=O)Cn3ccc4c(C)cccc34)c2c1
MolPort-035-765-711	0.61	CN1CCCC1CCn1cc(C2=C(C(=O)NC2=O)c2c[nH]c3ccccc23)c2ccccc12
MolPort-044-279-152	0.61	CCOc1c(Cl)cc(C=CC(=O)NCCc2c([nH]c3ccccc23)-c2ccc(F)cc2)cc1OC
MolPort-019-680-117	0.61	COc1ccc2[nH]cc(C3=CCN(CC3)C(=O)Cc3ccccc3O)c2c1
MolPort-003-933-638	0.61	Cl.NCCc1c[nH]c2ccc(O)cc12
MolPort-000-670-893	0.61	O.Cl.NCCc1c[nH]c2ccc(O)cc12
MolPort-046-793-371	0.61	Cl.[15NH2][13CH2][13CH2]c1c[nH]c2ccc(O)cc12
MolPort-046-766-162	0.61	Cl.[2H]C([2H])(N)C([2H])([2H])c1c[nH]c2ccc(O)cc12
MolPort-042-585-150	0.61	Oc1ccccc1CC(=O)NCCc1c[nH]c2ccc(Cl)cc12
MolPort-046-179-368	0.61	Cc1[nH]c2c(C)c(C)ccc2c1CCNC(=O)\C=C\c1cnc(N)nc1
MolPort-005-517-479	0.61	COc1ccc(cc1)C(CNC(=O)CN1CCNC(=O)C1)c1c[nH]c2ccccc12
MolPort-002-929-659	0.61	COc1cc(\C=C(\C#N)C(=O)NCCc2c[nH]c3ccccc23)ccc1OCC(=O)Nc1ccc(F)cc1
MolPort-002-713-043	0.61	COc1ccc(CC(=O)NCCc2c(C)[nH]c3ccccc23)cc1
MolPort-005-888-060	0.61	COc1ccc(CCNC(=O)C(=Cc2ccc(cc2)N(C)C)C(=O)NCCc2ccc(OC)cc2)cc1
MolPort-035-841-022	0.61	COc1ccc2[nH]cc(CCNC(=O)N3CC(C)(C)C3(C)C)c2c1
MolPort-038-968-098	0.61	CCOc1cccc2[nH]cc(CCNC(=O)C(C)C)c12
MolPort-044-271-361	0.61	COc1ccc2[nH]cc(C3=CCN(CC3)C(=O)C=CCN(C)C)c2c1
MolPort-044-273-324	0.61	COc1ccc(Cl)cc1C=CC(=O)N1CCC(CC1)c1c[nH]c2ccc(cc12)C(N)=O
MolPort-002-966-579	0.61	COc1cc(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)c(cc1OC)[N+]([O-])=O
MolPort-002-714-937	0.61	CC(C)COc1ccc(cc1)C(=O)N\C(=C/c1ccccc1)C(=O)NCCc1c(C)[nH]c2ccccc12
MolPort-002-715-097	0.61	COc1ccc(\C=C(/NC(=O)c2ccc(OCC(C)C)cc2)C(=O)NCCc2c(C)[nH]c3ccccc23)cc1
MolPort-004-896-867	0.61	COc1ccc(cc1)C(CNC(=O)c1ccccc1OC)c1c[nH]c2ccccc12
MolPort-044-272-221	0.61	O=C(C=Cc1cccc2cccnc12)N1CCOC(C1)c1ccccc1
MolPort-009-600-943	0.61	CC(C)CNC(=O)Cc1c[nH]c2ccccc12
MolPort-001-990-240	0.61	Cc1ccc(cc1)C(=O)N\C(=C/c1cccnc1)C(=O)NCCc1c[nH]c2ccccc12
MolPort-011-901-476	0.60	O=C(NCCc1c[nH]c2ccccc12)c1cn[nH]c1
MolPort-000-787-543	0.60	CC(C)(C)NCC(=O)c1c[nH]c2ccccc12
MolPort-001-823-756	0.60	CCN(CC)CC(=O)c1c[nH]c2ccccc12
MolPort-009-512-991	0.60	CCC(=O)NCC(c1c[nH]c2ccccc12)c1ccc(cc1)N(C)C
MolPort-009-513-520	0.60	O=C(NCCc1ccccc1)C(=Cc1cccnc1)C#N
MolPort-004-823-133	0.60	COc1ccc(CCNC(=O)C(=C/c2c(C)[nH]c3ccccc23)\C#N)cc1OC
MolPort-009-065-617	0.60	CCCCOc1ccc(CCNC(=O)Cc2c[nH]c3ccccc23)cc1
MolPort-028-825-676	0.60	COc1ccc(cc1)C(CNC(=O)Cc1ccc(Cl)c(Cl)c1)c1c[nH]c2ccccc12
MolPort-004-224-251	0.60	Cc1cc(C)cc(c1)C(=O)NCCc1c[nH]c2ccccc12
MolPort-004-307-928	0.60	OC(=O)C(Cc1c[nH]c2ccccc12)N1C(=O)C=CC1=O
MolPort-001-533-941	0.60	COc1ccc(CCNC(=O)C(=C\c2c(C)[nH]c3ccccc23)\C#N)cc1OC
MolPort-002-536-105	0.60	COc1cccc(OC)c1C(=O)NCCc1c[nH]c2ccccc12
MolPort-003-983-830	0.60	Cn1cc(C2=C(C(=O)NC2=O)c2ccc(Cl)cc2Cl)c2ccccc12
MolPort-020-065-117	0.60	CC(N(C)CC(N)=O)C(=O)NCCc1c[nH]c2ccccc12
MolPort-002-714-932	0.60	Cc1[nH]c2ccccc2c1CCNC(=O)C(\NC(=O)c1ccccc1)=C\c1cccc(Br)c1
MolPort-044-385-559	0.60	COc1ccc(CCNC(=O)C(=Cc2ccc(OCc3ccncc3)cc2)C#N)cc1OC
MolPort-039-032-407	0.60	Cn1ccc2cc(ccc12)C(O)CNC(=O)\C=C\c1ccc2OCOc2c1
MolPort-027-564-607	0.60	COc1ccc2[nH]cc(CCNC(=O)c3cccc4n(C)ccc34)c2c1
MolPort-005-892-590	0.60	CCN(CC)c1ccc(C=C(C(=O)NCCc2ccc(OC)cc2)C(=O)NCCc2ccc(OC)cc2)cc1
MolPort-020-017-486	0.60	COc1ccc(CCN(C)C(=O)C=Cc2ccccc2)cc1OC
MolPort-028-270-520	0.60	COC(C(=O)NCCc1c[nH]c2ccc(OC)cc12)c1ccccc1
MolPort-044-204-762	0.60	O=C(CCc1c[nH]c2ccccc12)N1CCN(CC=Cc2ccccc2)CC1
MolPort-044-223-742	0.60	Cn1cc(cn1)C(C)(O)CNC(=O)C=Cc1cn(C)c2ccccc12
MolPort-044-271-551	0.60	CNS(=O)(=O)c1ccc(C=CC(=O)NC(Cc2c[nH]c3ccccc23)C(O)=O)cc1
MolPort-027-837-602	0.60	Cl.CC(=O)N1CCN(CCc2c[nH]c3ccccc23)CC1
MolPort-023-298-975	0.60	COc1cc(CCNC(=O)\C=C\c2ccc(O)c(OC)c2)ccc1O
MolPort-044-204-198	0.60	CC1CN(CCN1)C(=O)C=Cc1ccnc2ccccc12
MolPort-044-204-206	0.60	CC1CN(CC(C)N1)C(=O)C=Cc1ccnc2ccccc12
MolPort-044-271-540	0.60	OC(=O)c1cccc(CCNC(=O)C=Cc2ccncc2)c1
MolPort-044-563-727	0.60	CCOc1ccc(CC(=O)NCCc2cn(CCC(C)C)c3ccccc23)cc1
MolPort-044-223-164	0.60	OCC(Cc1ccncc1)NC(=O)C=Cc1ccccc1Br
MolPort-039-032-407	0.60	Cn1ccc2cc(ccc12)C(O)CNC(=O)\C=C\c1ccc2OCOc2c1
MolPort-009-125-243	0.60	CC(C)c1ccc(OCC(=O)NCCc2c[nH]c3ccccc23)cc1
MolPort-044-385-260	0.60	COC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C(=Cc1ccc(cc1)N(C)C)C#N
MolPort-029-907-314	0.60	Cl.NCCCC(=O)NCCc1c[nH]c2ccccc12
MolPort-020-135-320	0.60	Cc1ccc2c(CCNC(=O)C3CC3)c[nH]c2c1
MolPort-044-534-199	0.60	Brc1ccc2[nH]cc(CC(=O)NC3CC3)c2c1
MolPort-046-076-363	0.60	COc1ccc2[nH]cc(CC(=O)N3CCN(C)CC3C(C)C)c2c1
MolPort-035-832-364	0.60	COc1ccc2[nH]cc(CC(=O)N(C)C3Cc4ccccc4C3)c2c1
MolPort-044-270-033	0.60	O=C(NCCc1cccs1)C=Cc1cccc2cccnc12
MolPort-044-270-035	0.60	O=C(C=Cc1cccc2cccnc12)N1CCc2ccccc12
MolPort-028-825-676	0.60	COc1ccc(cc1)C(CNC(=O)Cc1ccc(Cl)c(Cl)c1)c1c[nH]c2ccccc12
MolPort-044-239-817	0.60	Cn1cc(C=CC(=O)N(CCCO)CC(C)(C)C)c2ccccc12
MolPort-044-242-478	0.60	COc1ccccc1C=CC(=O)NCCc1ccccn1
MolPort-020-065-117	0.60	CC(N(C)CC(N)=O)C(=O)NCCc1c[nH]c2ccccc12
MolPort-020-055-474	0.60	FC(F)(F)CN(C1CC1)C(=O)C=Cc1ccnc2ccccc12
MolPort-005-558-147	0.60	COc1ccc(CC(=O)NCCc2c[nH]c3ccccc23)cc1F
MolPort-028-270-520	0.60	COC(C(=O)NCCc1c[nH]c2ccc(OC)cc12)c1ccccc1
MolPort-003-983-322	0.60	COc1ccc2[nH]cc(C3=CCNCC3)c2c1
MolPort-023-298-975	0.60	COc1cc(CCNC(=O)\C=C\c2ccc(O)c(OC)c2)ccc1O
MolPort-027-564-607	0.60	COc1ccc2[nH]cc(CCNC(=O)c3cccc4n(C)ccc34)c2c1
MolPort-004-896-865	0.60	COc1ccc(cc1)C(CNC(=O)c1cccc(C)c1)c1c[nH]c2ccccc12
MolPort-044-223-164	0.60	OCC(Cc1ccncc1)NC(=O)C=Cc1ccccc1Br
MolPort-044-563-727	0.60	CCOc1ccc(CC(=O)NCCc2cn(CCC(C)C)c3ccccc23)cc1
MolPort-004-097-182	0.60	COc1ccc(cc1)C(CNC(=O)c1ccncc1)c1c[nH]c2ccccc12
MolPort-009-555-984	0.60	CN(Cc1ccccc1O)C(=O)Cc1c[nH]c2ccccc12
MolPort-044-271-540	0.60	OC(=O)c1cccc(CCNC(=O)C=Cc2ccncc2)c1
MolPort-006-636-852	0.60	O=C(\C=C\c1ccccc1)N1CCC(Cc2ccc(cc2)-n2cccc2)CC1
MolPort-004-045-066	0.60	O=C(CCOc1ccccc1)NCCc1c[nH]c2ccccc12
MolPort-002-100-511	0.60	COc1ccc(CNCCc2c[nH]c3ccc(OC)cc23)cc1
MolPort-002-318-597	0.60	COc1ccc2[nH]cc(CCN(Cc3ccccc3)Cc3ccccc3)c2c1
MolPort-044-204-206	0.60	CC1CN(CC(C)N1)C(=O)C=Cc1ccnc2ccccc12
MolPort-044-204-198	0.60	CC1CN(CCN1)C(=O)C=Cc1ccnc2ccccc12
MolPort-027-837-602	0.60	Cl.CC(=O)N1CCN(CCc2c[nH]c3ccccc23)CC1
MolPort-000-808-467	0.60	COc1ccc2[nH]cc(CCN3C(=O)c4ccccc4C3=O)c2c1
MolPort-004-101-716	0.60	CCC(C)(C)NC(=O)Cc1c[nH]c2ccccc12
MolPort-009-509-196	0.60	CCC(C)NC(=O)Cc1c[nH]c2ccccc12
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MolPort-044-270-033	0.60	O=C(NCCc1cccs1)C=Cc1cccc2cccnc12
MolPort-001-736-386	0.60	COc1ccc2[nH]cc(CCNC(=O)c3ccccc3Cl)c2c1
MolPort-000-717-988	0.60	COc1ccc2[nH]cc(CCNC(=O)CCc3cc(c(O)c(c3)C(C)(C)C)C(C)(C)C)c2c1
MolPort-002-768-589	0.60	COc1ccc2[nH]cc(CCNC(=O)c3cccc(c3)C(F)(F)F)c2c1
MolPort-004-896-878	0.60	COc1ccc(cc1)C(CNC(=O)c1ccc(Br)cc1)c1c[nH]c2ccccc12
MolPort-010-680-243	0.60	COc1ccc2[nH]cc(CCNC(=O)CC3CCN(CC3)C(=O)C3CCCCC3)c2c1
MolPort-001-736-446	0.60	COc1ccc2[nH]cc(CCNC(=O)c3ccccc3I)c2c1
MolPort-001-736-450	0.60	COc1ccc2[nH]cc(CCNC(=O)c3ccc(OC(C)=O)cc3)c2c1
MolPort-046-076-363	0.60	COc1ccc2[nH]cc(CC(=O)N3CCN(C)CC3C(C)C)c2c1
MolPort-035-832-364	0.60	COc1ccc2[nH]cc(CC(=O)N(C)C3Cc4ccccc4C3)c2c1
MolPort-004-896-986	0.60	COc1ccc(OCC(=O)NCC(c2c[nH]c3ccccc23)c2ccc(OC)cc2)cc1
MolPort-000-375-128	0.60	COc1ccc(\C=C\C(=O)NCCc2ccccc2)cc1OC
MolPort-004-897-077	0.60	COc1ccc(cc1)C(=O)NCC(c1c[nH]c2ccccc12)c1ccccc1
MolPort-020-017-486	0.60	COc1ccc(CCN(C)C(=O)C=Cc2ccccc2)cc1OC
MolPort-002-715-094	0.60	Cc1[nH]c2ccccc2c1CCNC(=O)C(\NC(=O)c1ccccc1)=C\c1ccc(F)cc1
MolPort-044-385-559	0.60	COc1ccc(CCNC(=O)C(=Cc2ccc(OCc3ccncc3)cc2)C#N)cc1OC
MolPort-009-209-520	0.60	CC(C)C(=O)NCC(c1c[nH]c2ccccc12)c1ccc(cc1)N(C)C
MolPort-002-715-096	0.60	CCCCOc1ccc(cc1)C(=O)N\C(=C/c1ccc(OC)cc1)C(=O)NCCc1c(C)[nH]c2ccccc12
MolPort-003-711-140	0.60	CC(C)(C)[NH2+]CC(=O)c1c[nH]c2ccccc12
MolPort-044-239-817	0.60	Cn1cc(C=CC(=O)N(CCCO)CC(C)(C)C)c2ccccc12
MolPort-005-924-966	0.60	COc1ccc2[nH]cc(CCNC(=O)C3CCN(CC3)C(=O)C(c3ccccc3)c3ccccc3)c2c1
MolPort-044-242-478	0.60	COc1ccccc1C=CC(=O)NCCc1ccccn1
MolPort-002-768-921	0.60	Cc1cccc(c1)C(=O)NCCc1c[nH]c2ccccc12
MolPort-002-558-453	0.60	OC(=O)\C=C\C(=O)NC(Cc1c[nH]c2ccccc12)C(O)=O
MolPort-001-029-091	0.60	COc1ccc(\C=C\C(=O)NCC(C)c2ccccc2)cc1OC
MolPort-002-139-286	0.60	COc1ccc(CCNC(=O)\C=C/c2ccccc2)cc1OC
MolPort-000-818-898	0.60	Cl.Cl.COc1ccc2[nH]cc(CCNCCNCCS)c2c1
MolPort-020-055-474	0.60	FC(F)(F)CN(C1CC1)C(=O)C=Cc1ccnc2ccccc12

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