CSCC[C@@H](C)NC(=O)CCCOC(C)C	ZINC000784011962	BE	On-Demand	Anodyne	NOD1	41	32
CSCC[C@H](C)NC(=O)CCCOC(C)C	ZINC000784011963	BE	On-Demand	Anodyne	NOD1	41	32
CC[C@@H](C)CCCCC(=O)N[C@H](C)CCSC	ZINC000784015164	CH	On-Demand	Anodyne	NOD1	55	38
CC[C@@H](C)CCCCC(=O)N[C@@H](C)CCSC	ZINC000784015170	CH	On-Demand	Anodyne	NOD1	55	38
CCCCC[C@@H](C)NC(=O)C(C)(C)C(C)C	ZINC000784020314	BH	On-Demand	Anodyne	CELA2A	22	46
CCCCC[C@@H](C)NC(=O)C(C)(C)C(C)C	ZINC000784020314	BH	On-Demand	Anodyne	NOD1	80	39
CCCCC[C@@H](C)NC(=O)C(C)(C)C(C)C	ZINC000784020314	BH	On-Demand	Anodyne	CQSS	51	33
CC[C@H](C)[C@H](NC(=O)[C@H](F)C(C)C)C(=O)OC	ZINC000784022231	BD	On-Demand	Anodyne	PAPA1_CARPA	46	34
CC[C@H](C)[C@H](NC(=O)[C@H](F)C(C)C)C(=O)OC	ZINC000784022231	BD	On-Demand	Anodyne	ENPEP	72	36
CC[C@H](C)[C@H](NC(=O)[C@@H](F)C(C)C)C(=O)OC	ZINC000784022244	BD	On-Demand	Anodyne	PAPA1_CARPA	46	34
CC[C@H](C)[C@H](NC(=O)[C@@H](F)C(C)C)C(=O)OC	ZINC000784022244	BD	On-Demand	Anodyne	ENPEP	72	36
CCCCC[C@@H](C)NC(=O)[C@H](F)C(C)C	ZINC000784022992	BG	On-Demand	Anodyne	NOD1	51	36
CCCCC[C@@H](C)NC(=O)[C@H](F)C(C)C	ZINC000784022992	BG	On-Demand	Anodyne	CQSS	52	33
CCCCC[C@@H](C)NC(=O)[C@@H](F)C(C)C	ZINC000784022994	BG	On-Demand	Anodyne	NOD1	51	36
CCCCC[C@@H](C)NC(=O)[C@@H](F)C(C)C	ZINC000784022994	BG	On-Demand	Anodyne	CQSS	52	33
CCOC(=O)[C@H](C)NC(=O)CCCOC(C)C	ZINC000784026515	BD	On-Demand	Anodyne	NOD1	78	38
CCOC(=O)[C@H](C)NC(=O)CCCC[C@H](C)CC	ZINC000784027923	CF	On-Demand	Anodyne	NOD1	95	43
CCOC(=O)[C@H](C)NC(=O)CCCC[C@H](C)CC	ZINC000784027923	CF	On-Demand	Anodyne	CQSS	40	33
CCOC(=O)[C@H](C)NC(=O)CCCC[C@@H](C)CC	ZINC000784027926	CF	On-Demand	Anodyne	NOD1	95	43
CCOC(=O)[C@H](C)NC(=O)CCCC[C@@H](C)CC	ZINC000784027926	CF	On-Demand	Anodyne	CQSS	40	33
CCOC(=O)N[C@@H](CNC(=O)[C@@H](F)C(C)C)CC(C)C	ZINC000784052330	CE	On-Demand	Anodyne	HLA-DRB1	43	35
CCOC(=O)N[C@@H](CNC(=O)[C@@H](F)C(C)C)CC(C)C	ZINC000784052330	CE	On-Demand	Anodyne	CAPN2	46	31
CCOC(=O)N[C@H](CNC(=O)[C@H](F)C(C)C)CC(C)C	ZINC000784052331	CE	On-Demand	Anodyne	HLA-DRB1	43	35
CCOC(=O)N[C@H](CNC(=O)[C@H](F)C(C)C)CC(C)C	ZINC000784052331	CE	On-Demand	Anodyne	CAPN2	46	31
CCOC(=O)N[C@H](CNC(=O)[C@@H](F)C(C)C)CC(C)C	ZINC000784052334	CE	On-Demand	Anodyne	HLA-DRB1	43	35
CCOC(=O)N[C@H](CNC(=O)[C@@H](F)C(C)C)CC(C)C	ZINC000784052334	CE	On-Demand	Anodyne	CAPN2	46	31
CCOC(=O)N[C@@H](CNC(=O)[C@H](F)C(C)C)CC(C)C	ZINC000784052337	CE	On-Demand	Anodyne	HLA-DRB1	43	35
CCOC(=O)N[C@@H](CNC(=O)[C@H](F)C(C)C)CC(C)C	ZINC000784052337	CE	On-Demand	Anodyne	CAPN2	46	31
CCCCN(CC(F)(F)F)C(=O)[C@H](F)C(C)C	ZINC000784055535	CG	On-Demand	Anodyne	EST1_PIG	44	32
CCCCN(CC(F)(F)F)C(=O)[C@@H](F)C(C)C	ZINC000784055536	CG	On-Demand	Anodyne	EST1_PIG	44	32
CCOC(=O)[C@@H](NC(=O)CCCOC(C)C)C(C)(C)C	ZINC000784065088	CE	On-Demand	Anodyne	PDF	50	32
CCOC(=O)[C@@H](NC(=O)CCCOC(C)C)C(C)(C)C	ZINC000784065088	CE	On-Demand	Anodyne	NOD1	61	36
C#CCCCCNC(=O)CCCC[C@@H](C)CC	ZINC000784070835	BH	On-Demand	Mild	NOD1	28	41
C#CCCCCNC(=O)CCCC[C@H](C)CC	ZINC000784070836	BH	On-Demand	Mild	NOD1	28	41
COC[C@@H](NC(=O)CCCOC(C)C)C(N)=O	ZINC000784087931	BB	On-Demand	Anodyne	NOD1	74	35
COC[C@H](NC(=O)CCCOC(C)C)C(N)=O	ZINC000784087942	BB	On-Demand	Anodyne	NOD1	74	35
CC[C@@H](C)CCCCC(=O)N[C@H](COC)C(N)=O	ZINC000784089288	CD	On-Demand	Anodyne	NMT1	16	43
CC[C@@H](C)CCCCC(=O)N[C@H](COC)C(N)=O	ZINC000784089288	CD	On-Demand	Anodyne	HLA-DRB1	43	35
CC[C@@H](C)CCCCC(=O)N[C@H](COC)C(N)=O	ZINC000784089288	CD	On-Demand	Anodyne	NOD1	99	44
CC[C@@H](C)CCCCC(=O)N[C@@H](COC)C(N)=O	ZINC000784089289	CD	On-Demand	Anodyne	NMT1	16	43
CC[C@@H](C)CCCCC(=O)N[C@@H](COC)C(N)=O	ZINC000784089289	CD	On-Demand	Anodyne	HLA-DRB1	43	35
CC[C@@H](C)CCCCC(=O)N[C@@H](COC)C(N)=O	ZINC000784089289	CD	On-Demand	Anodyne	NOD1	99	44
CCCCCCCCNC(=O)NCCS(=O)(=O)NC	ZINC000784101433	CD	On-Demand	Mild	EST1_PIG	54	38
CCCCCCCCNC(=O)NCCS(=O)(=O)NC	ZINC000784101433	CD	On-Demand	Mild	EPHX2	22	56
CCCCCCCCNC(=O)NCCS(=O)(=O)NC	ZINC000784101433	CD	On-Demand	Mild	CES2C	49	38
CCCCCCCCNC(=O)NCCS(=O)(=O)NC	ZINC000784101433	CD	On-Demand	Mild	ASAH1	86	34
CC(C)[C@H](CNC(=O)C(C)(C)C(C)C)NC(=O)OC(C)(C)C	ZINC000784107837	DG	On-Demand	Anodyne	CTSK	18	45
CCOC(=O)[C@@H](NC(=O)[C@H](F)C(C)C)C(C)(C)C	ZINC000784130579	CE	On-Demand	Anodyne	PDF	60	35
CCOC(=O)[C@@H](NC(=O)[C@@H](F)C(C)C)C(C)(C)C	ZINC000784130582	CE	On-Demand	Anodyne	PDF	60	35
CC[C@H](C)[C@H](NC(=O)[C@@H](F)C(C)C)C(=O)OC(C)(C)C	ZINC000784136153	CF	On-Demand	Anodyne	CTSD	15	43
CC[C@H](C)[C@H](NC(=O)[C@@H](F)C(C)C)C(=O)OC(C)(C)C	ZINC000784136153	CF	On-Demand	Anodyne	ECE1	31	43
CC[C@H](C)[C@H](NC(=O)[C@@H](F)C(C)C)C(=O)OC(C)(C)C	ZINC000784136153	CF	On-Demand	Anodyne	ENPEP	57	33
CC[C@H](C)[C@H](NC(=O)[C@@H](F)C(C)C)C(=O)OC(C)(C)C	ZINC000784136153	CF	On-Demand	Anodyne	POLG_HCV1	21	41
CC[C@H](C)[C@H](NC(=O)[C@H](F)C(C)C)C(=O)OC(C)(C)C	ZINC000784136154	CF	On-Demand	Anodyne	CTSD	15	43
CC[C@H](C)[C@H](NC(=O)[C@H](F)C(C)C)C(=O)OC(C)(C)C	ZINC000784136154	CF	On-Demand	Anodyne	ECE1	31	43
CC[C@H](C)[C@H](NC(=O)[C@H](F)C(C)C)C(=O)OC(C)(C)C	ZINC000784136154	CF	On-Demand	Anodyne	ENPEP	57	33
CC[C@H](C)[C@H](NC(=O)[C@H](F)C(C)C)C(=O)OC(C)(C)C	ZINC000784136154	CF	On-Demand	Anodyne	POLG_HCV1	21	41
CCCCCCCCNC(=O)[C@H](F)C(C)C	ZINC000784139553	BG	On-Demand	Mild	CES2	49	41
CCCCCCCCNC(=O)[C@H](F)C(C)C	ZINC000784139553	BG	On-Demand	Mild	S1PR2	20	44
CCCCCCCCNC(=O)[C@H](F)C(C)C	ZINC000784139553	BG	On-Demand	Mild	EST1_PIG	66	41
CCCCCCCCNC(=O)[C@H](F)C(C)C	ZINC000784139553	BG	On-Demand	Mild	EPHX2	15	45
CCCCCCCCNC(=O)[C@H](F)C(C)C	ZINC000784139553	BG	On-Demand	Mild	CES2C	57	41
CCCCCCCCNC(=O)[C@H](F)C(C)C	ZINC000784139553	BG	On-Demand	Mild	ASAH1	99	38
CCCCCCCCNC(=O)[C@H](F)C(C)C	ZINC000784139553	BG	On-Demand	Mild	NOD1	45	40
CCCCCCCCNC(=O)[C@H](F)C(C)C	ZINC000784139553	BG	On-Demand	Mild	CQSS	58	38
CCCCCCCCNC(=O)[C@@H](F)C(C)C	ZINC000784139554	BG	On-Demand	Mild	CES2	49	41
CCCCCCCCNC(=O)[C@@H](F)C(C)C	ZINC000784139554	BG	On-Demand	Mild	S1PR2	20	44
CCCCCCCCNC(=O)[C@@H](F)C(C)C	ZINC000784139554	BG	On-Demand	Mild	EST1_PIG	66	41
CCCCCCCCNC(=O)[C@@H](F)C(C)C	ZINC000784139554	BG	On-Demand	Mild	EPHX2	15	45
CCCCCCCCNC(=O)[C@@H](F)C(C)C	ZINC000784139554	BG	On-Demand	Mild	CES2C	57	41
CCCCCCCCNC(=O)[C@@H](F)C(C)C	ZINC000784139554	BG	On-Demand	Mild	ASAH1	99	38
CCCCCCCCNC(=O)[C@@H](F)C(C)C	ZINC000784139554	BG	On-Demand	Mild	NOD1	45	40
CCCCCCCCNC(=O)[C@@H](F)C(C)C	ZINC000784139554	BG	On-Demand	Mild	CQSS	58	38
CCCCSCC(=O)NC[C@@H](SC)C(C)(C)C	ZINC000784153091	CG	On-Demand	Anodyne	CES1	17	43
CCCCSCC(=O)NC[C@@H](SC)C(C)(C)C	ZINC000784153091	CG	On-Demand	Anodyne	EST1_PIG	49	43
CCCCSCC(=O)NC[C@H](SC)C(C)(C)C	ZINC000784153092	CG	On-Demand	Anodyne	CES1	17	43
CCCCSCC(=O)NC[C@H](SC)C(C)(C)C	ZINC000784153092	CG	On-Demand	Anodyne	EST1_PIG	49	43
CCCC[C@H](CNC(=O)OC(C)(C)C)NC(=O)[C@H](F)C(C)C	ZINC000784156041	DG	On-Demand	Anodyne	PAPA1_CARPA	36	42
CCCC[C@H](CNC(=O)OC(C)(C)C)NC(=O)[C@H](F)C(C)C	ZINC000784156041	DG	On-Demand	Anodyne	CTSK	31	45
CCCC[C@H](CNC(=O)OC(C)(C)C)NC(=O)[C@H](F)C(C)C	ZINC000784156041	DG	On-Demand	Anodyne	PGA5	24	45
CCCC[C@H](CNC(=O)OC(C)(C)C)NC(=O)[C@@H](F)C(C)C	ZINC000784156045	DG	On-Demand	Anodyne	PAPA1_CARPA	36	42
CCCC[C@H](CNC(=O)OC(C)(C)C)NC(=O)[C@@H](F)C(C)C	ZINC000784156045	DG	On-Demand	Anodyne	CTSK	31	45
CCCC[C@H](CNC(=O)OC(C)(C)C)NC(=O)[C@@H](F)C(C)C	ZINC000784156045	DG	On-Demand	Anodyne	PGA5	24	45
CCCC[C@@H](CNC(=O)OC(C)(C)C)NC(=O)[C@H](F)C(C)C	ZINC000784156052	DG	On-Demand	Anodyne	PAPA1_CARPA	36	42
CCCC[C@@H](CNC(=O)OC(C)(C)C)NC(=O)[C@H](F)C(C)C	ZINC000784156052	DG	On-Demand	Anodyne	CTSK	31	45
CCCC[C@@H](CNC(=O)OC(C)(C)C)NC(=O)[C@H](F)C(C)C	ZINC000784156052	DG	On-Demand	Anodyne	PGA5	24	45
CCCC[C@@H](CNC(=O)OC(C)(C)C)NC(=O)[C@@H](F)C(C)C	ZINC000784156062	DG	On-Demand	Anodyne	PAPA1_CARPA	36	42
CCCC[C@@H](CNC(=O)OC(C)(C)C)NC(=O)[C@@H](F)C(C)C	ZINC000784156062	DG	On-Demand	Anodyne	CTSK	31	45
CCCC[C@@H](CNC(=O)OC(C)(C)C)NC(=O)[C@@H](F)C(C)C	ZINC000784156062	DG	On-Demand	Anodyne	PGA5	24	45
CCCC[C@@H](NC(=O)[C@@H](F)C(C)C)C(=O)OC(C)(C)C	ZINC000784156320	CF	On-Demand	Anodyne	SSTR2	42	33
CCCC[C@@H](NC(=O)[C@@H](F)C(C)C)C(=O)OC(C)(C)C	ZINC000784156320	CF	On-Demand	Anodyne	CTSK	25	43
CCCC[C@@H](NC(=O)[C@@H](F)C(C)C)C(=O)OC(C)(C)C	ZINC000784156320	CF	On-Demand	Anodyne	PGA5	23	43
CCCC[C@@H](NC(=O)[C@@H](F)C(C)C)C(=O)OC(C)(C)C	ZINC000784156320	CF	On-Demand	Anodyne	NOD1	56	33
CCCC[C@H](NC(=O)[C@H](F)C(C)C)C(=O)OC(C)(C)C	ZINC000784156322	CF	On-Demand	Anodyne	SSTR2	42	33
CCCC[C@H](NC(=O)[C@H](F)C(C)C)C(=O)OC(C)(C)C	ZINC000784156322	CF	On-Demand	Anodyne	CTSK	25	43
CCCC[C@H](NC(=O)[C@H](F)C(C)C)C(=O)OC(C)(C)C	ZINC000784156322	CF	On-Demand	Anodyne	PGA5	23	43
CCCC[C@H](NC(=O)[C@H](F)C(C)C)C(=O)OC(C)(C)C	ZINC000784156322	CF	On-Demand	Anodyne	NOD1	56	33
CCCC[C@H](NC(=O)[C@@H](F)C(C)C)C(=O)OC(C)(C)C	ZINC000784156323	CF	On-Demand	Anodyne	SSTR2	42	33
CCCC[C@H](NC(=O)[C@@H](F)C(C)C)C(=O)OC(C)(C)C	ZINC000784156323	CF	On-Demand	Anodyne	CTSK	25	43
CCCC[C@H](NC(=O)[C@@H](F)C(C)C)C(=O)OC(C)(C)C	ZINC000784156323	CF	On-Demand	Anodyne	PGA5	23	43
CCCC[C@H](NC(=O)[C@@H](F)C(C)C)C(=O)OC(C)(C)C	ZINC000784156323	CF	On-Demand	Anodyne	NOD1	56	33
CCCC[C@@H](NC(=O)[C@H](F)C(C)C)C(=O)OC(C)(C)C	ZINC000784156324	CF	On-Demand	Anodyne	SSTR2	42	33
CCCC[C@@H](NC(=O)[C@H](F)C(C)C)C(=O)OC(C)(C)C	ZINC000784156324	CF	On-Demand	Anodyne	CTSK	25	43
CCCC[C@@H](NC(=O)[C@H](F)C(C)C)C(=O)OC(C)(C)C	ZINC000784156324	CF	On-Demand	Anodyne	PGA5	23	43
CCCC[C@@H](NC(=O)[C@H](F)C(C)C)C(=O)OC(C)(C)C	ZINC000784156324	CF	On-Demand	Anodyne	NOD1	56	33
CCCCCCC(=O)NC[C@@H](SC)C(C)(C)C	ZINC000784158405	CH	On-Demand	Anodyne	EST1_PIG	42	36
CCCCCCC(=O)NC[C@@H](SC)C(C)(C)C	ZINC000784158405	CH	On-Demand	Anodyne	NOD1	60	38
CCCCCCC(=O)NC[C@@H](SC)C(C)(C)C	ZINC000784158405	CH	On-Demand	Anodyne	CQSS	62	38
CCCCCCC(=O)NC[C@H](SC)C(C)(C)C	ZINC000784158407	CH	On-Demand	Anodyne	EST1_PIG	42	36
CCCCCCC(=O)NC[C@H](SC)C(C)(C)C	ZINC000784158407	CH	On-Demand	Anodyne	NOD1	60	38
CCCCCCC(=O)NC[C@H](SC)C(C)(C)C	ZINC000784158407	CH	On-Demand	Anodyne	CQSS	62	38
C#CCOCCNC(=O)NCCCCCC	ZINC000784173063	BD	On-Demand	Mild	EPHX2	25	47
C#CCOCCNC(=O)NCCCCCC	ZINC000784173063	BD	On-Demand	Mild	ASAH1	64	31
CCCCC[C@@H](C)NC(=O)NCCCC#N	ZINC000784173955	BF	On-Demand	Mild	NOD1	43	35
C/C=C/C=C/C(=O)OCC(=O)CCCCCC	ZINC000784185799	BG	On-Demand	Anodyne	CQSS	54	34
C/C=C/C=C\C(=O)OCC(=O)CCCCCC	ZINC000784185800	BG	On-Demand	Anodyne	CQSS	54	34
CCCCCCC(=O)COC(=O)CC(C)(C)C	ZINC000784186113	BH	On-Demand	Anodyne	CQSS	58	37
CCCCCCC(=O)COC(=O)C=C(C)C	ZINC000784186529	BG	On-Demand	Anodyne	CQSS	58	37
CCCCCCC(=O)COC(=O)C(C)C	ZINC000784186536	BF	On-Demand	Anodyne	PLA2G4B	55	34
CCCCCCC(=O)COC(=O)C(C)C	ZINC000784186536	BF	On-Demand	Anodyne	LPAR3	44	39
CCCCCCC(=O)COC(=O)C(C)C	ZINC000784186536	BF	On-Demand	Anodyne	FABP5	15	43
CCCCCCC(=O)COC(=O)C(C)C	ZINC000784186536	BF	On-Demand	Anodyne	ENPP2	19	40
CCCCCCC(=O)COC(=O)C(C)C	ZINC000784186536	BF	On-Demand	Anodyne	NOD1	77	37
CCCCCCC(=O)COC(=O)C(C)C	ZINC000784186536	BF	On-Demand	Anodyne	CQSS	72	47
CCCCCCC(=O)COC(=O)CC	ZINC000784186861	BE	On-Demand	Anodyne	PLA2G4B	59	35
CCCCCCC(=O)COC(=O)CC	ZINC000784186861	BE	On-Demand	Anodyne	LPAR3	40	38
CCCCCCC(=O)COC(=O)CC	ZINC000784186861	BE	On-Demand	Anodyne	FABP5	15	45
CCCCCCC(=O)COC(=O)CC	ZINC000784186861	BE	On-Demand	Anodyne	NOD1	41	31
CCCCCCC(=O)COC(=O)CC	ZINC000784186861	BE	On-Demand	Anodyne	CQSS	69	42
CCCCCCC(=O)COC(=O)CC(C)C	ZINC000784187082	BG	On-Demand	Anodyne	PLA2G4B	46	33
CCCCCCC(=O)COC(=O)CC(C)C	ZINC000784187082	BG	On-Demand	Anodyne	PRKCA	24	41
CCCCCCC(=O)COC(=O)CC(C)C	ZINC000784187082	BG	On-Demand	Anodyne	NOD1	70	35
CCCCCCC(=O)COC(=O)CC(C)C	ZINC000784187082	BG	On-Demand	Anodyne	CQSS	68	44
CCCCCCC(=O)COC(=O)CCC	ZINC000784187087	BF	On-Demand	Anodyne	PLA2G4B	59	35
CCCCCCC(=O)COC(=O)CCC	ZINC000784187087	BF	On-Demand	Anodyne	LPAR3	41	41
CCCCCCC(=O)COC(=O)CCC	ZINC000784187087	BF	On-Demand	Anodyne	FABP5	15	45
CCCCCCC(=O)COC(=O)CCC	ZINC000784187087	BF	On-Demand	Anodyne	ENPP2	15	40
CCCCCCC(=O)COC(=O)CCC	ZINC000784187087	BF	On-Demand	Anodyne	NOD1	46	33
CCCCCCC(=O)COC(=O)CCC	ZINC000784187087	BF	On-Demand	Anodyne	CQSS	65	41
CCCCCCC(=O)COC(=O)COC	ZINC000784187779	BD	On-Demand	Anodyne	PLA2G4B	50	33
CCCCCCC(=O)COC(=O)COC	ZINC000784187779	BD	On-Demand	Anodyne	CQSS	61	39
CCCCCCC(=O)COC(=O)[C@H](C)CC	ZINC000784194553	BG	On-Demand	Anodyne	PLA2G4B	46	33
CCCCCCC(=O)COC(=O)[C@H](C)CC	ZINC000784194553	BG	On-Demand	Anodyne	NOD1	89	38
CCCCCCC(=O)COC(=O)[C@H](C)CC	ZINC000784194553	BG	On-Demand	Anodyne	CQSS	72	46
CCCCCCC(=O)COC(=O)[C@@H](C)CC	ZINC000784194554	BG	On-Demand	Anodyne	PLA2G4B	46	33
CCCCCCC(=O)COC(=O)[C@@H](C)CC	ZINC000784194554	BG	On-Demand	Anodyne	NOD1	89	38
CCCCCCC(=O)COC(=O)[C@@H](C)CC	ZINC000784194554	BG	On-Demand	Anodyne	CQSS	72	46
CC/C=C(\C)C(=O)OCC(=O)CCCCCC	ZINC000784194652	BG	On-Demand	Anodyne	CQSS	55	35
CC/C=C(/C)C(=O)OCC(=O)CCCCCC	ZINC000784194654	BG	On-Demand	Anodyne	CQSS	55	35
CCCCCCC(=O)COC(=O)CN(C)C(C)=O	ZINC000784204707	CD	On-Demand	Anodyne	CQSS	54	34
CCCCCCC(=O)COC(=O)CN(C)S(C)(=O)=O	ZINC000784205065	CC	On-Demand	Anodyne	CQSS	51	33
CCCCCCC(=O)COC(=O)[C@H](C)S(C)(=O)=O	ZINC000784208448	CD	On-Demand	Anodyne	NOD1	55	33
CCCCCCC(=O)COC(=O)[C@H](C)S(C)(=O)=O	ZINC000784208448	CD	On-Demand	Anodyne	CQSS	62	41
CCCCCCC(=O)COC(=O)[C@@H](C)S(C)(=O)=O	ZINC000784208449	CD	On-Demand	Anodyne	NOD1	55	33
CCCCCCC(=O)COC(=O)[C@@H](C)S(C)(=O)=O	ZINC000784208449	CD	On-Demand	Anodyne	CQSS	62	41
CCCCCCC(=O)COC(=O)C(C)(C)C#N	ZINC000784209098	BF	On-Demand	Mild	CES2	47	39
CCCCCCC(=O)COC(=O)C(C)(C)C#N	ZINC000784209098	BF	On-Demand	Mild	EST1_PIG	62	39
CCCCCCC(=O)COC(=O)C(C)(C)C#N	ZINC000784209098	BF	On-Demand	Mild	CES2C	54	36
CCCCCCC(=O)COC(=O)C(C)(C)C#N	ZINC000784209098	BF	On-Demand	Mild	CQSS	54	34
CCCCCCC(=O)COC(=O)[C@H](C)OC	ZINC000784209466	BE	On-Demand	Anodyne	ENPP2	28	43
CCCCCCC(=O)COC(=O)[C@H](C)OC	ZINC000784209466	BE	On-Demand	Anodyne	LASR	40	35
CCCCCCC(=O)COC(=O)[C@H](C)OC	ZINC000784209466	BE	On-Demand	Anodyne	NOD1	87	37
CCCCCCC(=O)COC(=O)[C@H](C)OC	ZINC000784209466	BE	On-Demand	Anodyne	CQSS	66	43
CCCCCCC(=O)COC(=O)[C@@H](C)OC	ZINC000784209468	BE	On-Demand	Anodyne	ENPP2	28	43
CCCCCCC(=O)COC(=O)[C@@H](C)OC	ZINC000784209468	BE	On-Demand	Anodyne	LASR	40	35
CCCCCCC(=O)COC(=O)[C@@H](C)OC	ZINC000784209468	BE	On-Demand	Anodyne	NOD1	87	37
CCCCCCC(=O)COC(=O)[C@@H](C)OC	ZINC000784209468	BE	On-Demand	Anodyne	CQSS	66	43
CCCCCCC(=O)COC(=O)C(C)(C)C	ZINC000784209614	BG	On-Demand	Anodyne	PLA2G4B	62	33
CCCCCCC(=O)COC(=O)C(C)(C)C	ZINC000784209614	BG	On-Demand	Anodyne	CES2	48	41
CCCCCCC(=O)COC(=O)C(C)(C)C	ZINC000784209614	BG	On-Demand	Anodyne	CES1	26	41
CCCCCCC(=O)COC(=O)C(C)(C)C	ZINC000784209614	BG	On-Demand	Anodyne	EST1_PIG	63	41
CCCCCCC(=O)COC(=O)C(C)(C)C	ZINC000784209614	BG	On-Demand	Anodyne	CES2C	55	37
CCCCCCC(=O)COC(=O)C(C)(C)C	ZINC000784209614	BG	On-Demand	Anodyne	NOD1	48	30
CCCCCCC(=O)COC(=O)C(C)(C)C	ZINC000784209614	BG	On-Demand	Anodyne	CQSS	61	39
CCCCCCC(=O)COC(=O)CS(C)(=O)=O	ZINC000784214270	CD	On-Demand	Anodyne	NOD1	49	30
CCCCCCC(=O)COC(=O)CS(C)(=O)=O	ZINC000784214270	CD	On-Demand	Anodyne	CQSS	57	36
CCCCCCC(=O)COC(=O)C(C)(C)CO	ZINC000784217047	BE	On-Demand	Anodyne	CQSS	57	36
CCCCCCC(=O)COC(=O)C(C)(C)NC(C)=O	ZINC000784218762	CD	On-Demand	Anodyne	CQSS	53	33
CCCCCCC(=O)COC(=O)C(C)(C)CC	ZINC000784218898	BH	On-Demand	Anodyne	CQSS	58	37
CCCCCCC(=O)COC(=O)C(C)(C)OC	ZINC000784225859	BE	On-Demand	Anodyne	CQSS	63	39
CCCCCCC(=O)COC(=O)[C@H](C)C(C)C	ZINC000784229646	BG	On-Demand	Anodyne	PLA2G4B	46	33
CCCCCCC(=O)COC(=O)[C@H](C)C(C)C	ZINC000784229646	BG	On-Demand	Anodyne	NOD1	66	35
CCCCCCC(=O)COC(=O)[C@H](C)C(C)C	ZINC000784229646	BG	On-Demand	Anodyne	CQSS	68	44
CCCCCCC(=O)COC(=O)[C@@H](C)C(C)C	ZINC000784229648	BG	On-Demand	Anodyne	PLA2G4B	46	33
CCCCCCC(=O)COC(=O)[C@@H](C)C(C)C	ZINC000784229648	BG	On-Demand	Anodyne	NOD1	66	35
CCCCCCC(=O)COC(=O)[C@@H](C)C(C)C	ZINC000784229648	BG	On-Demand	Anodyne	CQSS	68	44
CCCCCCC(=O)COC(=O)[C@@H](C)C(F)(F)F	ZINC000784229698	CG	On-Demand	Anodyne	CES2	53	44
CCCCCCC(=O)COC(=O)[C@@H](C)C(F)(F)F	ZINC000784229698	CG	On-Demand	Anodyne	CES1	56	44
CCCCCCC(=O)COC(=O)[C@@H](C)C(F)(F)F	ZINC000784229698	CG	On-Demand	Anodyne	EST1_PIG	75	44
CCCCCCC(=O)COC(=O)[C@@H](C)C(F)(F)F	ZINC000784229698	CG	On-Demand	Anodyne	CES2C	61	40
CCCCCCC(=O)COC(=O)[C@@H](C)C(F)(F)F	ZINC000784229698	CG	On-Demand	Anodyne	LPAR3	42	38
CCCCCCC(=O)COC(=O)[C@@H](C)C(F)(F)F	ZINC000784229698	CG	On-Demand	Anodyne	NOD1	55	33
CCCCCCC(=O)COC(=O)[C@@H](C)C(F)(F)F	ZINC000784229698	CG	On-Demand	Anodyne	CQSS	62	41
CCCCCCC(=O)COC(=O)[C@H](C)C(F)(F)F	ZINC000784229700	CG	On-Demand	Anodyne	CES2	53	44
CCCCCCC(=O)COC(=O)[C@H](C)C(F)(F)F	ZINC000784229700	CG	On-Demand	Anodyne	CES1	56	44
CCCCCCC(=O)COC(=O)[C@H](C)C(F)(F)F	ZINC000784229700	CG	On-Demand	Anodyne	EST1_PIG	75	44
CCCCCCC(=O)COC(=O)[C@H](C)C(F)(F)F	ZINC000784229700	CG	On-Demand	Anodyne	CES2C	61	40
CCCCCCC(=O)COC(=O)[C@H](C)C(F)(F)F	ZINC000784229700	CG	On-Demand	Anodyne	LPAR3	42	38
CCCCCCC(=O)COC(=O)[C@H](C)C(F)(F)F	ZINC000784229700	CG	On-Demand	Anodyne	NOD1	55	33
CCCCCCC(=O)COC(=O)[C@H](C)C(F)(F)F	ZINC000784229700	CG	On-Demand	Anodyne	CQSS	62	41
C/C=C(\C)C(=O)OCC(=O)CCCCCC	ZINC000784229747	BG	On-Demand	Anodyne	PLA2G4B	59	35
C/C=C(\C)C(=O)OCC(=O)CCCCCC	ZINC000784229747	BG	On-Demand	Anodyne	ATP2A1	43	31
C/C=C(\C)C(=O)OCC(=O)CCCCCC	ZINC000784229747	BG	On-Demand	Anodyne	CQSS	58	37
C/C=C(/C)C(=O)OCC(=O)CCCCCC	ZINC000784229748	BG	On-Demand	Anodyne	PLA2G4B	59	35
C/C=C(/C)C(=O)OCC(=O)CCCCCC	ZINC000784229748	BG	On-Demand	Anodyne	ATP2A1	43	31
C/C=C(/C)C(=O)OCC(=O)CCCCCC	ZINC000784229748	BG	On-Demand	Anodyne	CQSS	58	37
CCCCCCC(=O)COC(=O)C(C)=C(C)C	ZINC000784230996	BG	On-Demand	Anodyne	PLA2G4B	46	33
CCCCCCC(=O)COC(=O)C(C)=C(C)C	ZINC000784230996	BG	On-Demand	Anodyne	CQSS	60	38
CCCCCCC(=O)COC(=O)C(C)(C)NS(C)(=O)=O	ZINC000784233354	DD	On-Demand	Anodyne	CQSS	50	32
CCCCCCC(=O)COC(=O)/C=C/SC	ZINC000784238629	BF	On-Demand	Anodyne	CQSS	54	34
CCCCCCC(=O)COC(=O)/C=C\SC	ZINC000784238630	BF	On-Demand	Anodyne	CQSS	54	34
CCCCCCC(=O)COC(=O)C(C)(C)F	ZINC000784240631	BF	On-Demand	Anodyne	PLA2G4B	41	32
CCCCCCC(=O)COC(=O)C(C)(C)F	ZINC000784240631	BF	On-Demand	Anodyne	CES2	56	47
CCCCCCC(=O)COC(=O)C(C)(C)F	ZINC000784240631	BF	On-Demand	Anodyne	CES1	57	47
CCCCCCC(=O)COC(=O)C(C)(C)F	ZINC000784240631	BF	On-Demand	Anodyne	EST1_PIG	82	47
CCCCCCC(=O)COC(=O)C(C)(C)F	ZINC000784240631	BF	On-Demand	Anodyne	CES2C	64	42
CCCCCCC(=O)COC(=O)C(C)(C)F	ZINC000784240631	BF	On-Demand	Anodyne	CQSS	58	37
CCCCCCC(=O)COC(=O)C(C)(Cl)Cl	ZINC000784241988	CG	On-Demand	Anodyne	CQSS	58	37
CCCCCCC(=O)COC(=O)[C@H](C)NS(C)(=O)=O	ZINC000784246411	CD	On-Demand	Anodyne	LASR	40	35
CCCCCCC(=O)COC(=O)[C@H](C)NS(C)(=O)=O	ZINC000784246411	CD	On-Demand	Anodyne	NOD1	56	33
CCCCCCC(=O)COC(=O)[C@H](C)NS(C)(=O)=O	ZINC000784246411	CD	On-Demand	Anodyne	CQSS	58	38
CCCCCCC(=O)COC(=O)[C@@H](C)NS(C)(=O)=O	ZINC000784246412	CD	On-Demand	Anodyne	LASR	40	35
CCCCCCC(=O)COC(=O)[C@@H](C)NS(C)(=O)=O	ZINC000784246412	CD	On-Demand	Anodyne	NOD1	56	33
CCCCCCC(=O)COC(=O)[C@@H](C)NS(C)(=O)=O	ZINC000784246412	CD	On-Demand	Anodyne	CQSS	58	38
CCCCCCC(=O)COC(=O)[C@@](C)(O)C(C)C	ZINC000784251054	CE	On-Demand	Anodyne	NOD1	64	33
CCCCCCC(=O)COC(=O)[C@@](C)(O)C(C)C	ZINC000784251054	CE	On-Demand	Anodyne	CQSS	62	41
CCCCCCC(=O)COC(=O)[C@](C)(O)C(C)C	ZINC000784251055	CE	On-Demand	Anodyne	NOD1	64	33
CCCCCCC(=O)COC(=O)[C@](C)(O)C(C)C	ZINC000784251055	CE	On-Demand	Anodyne	CQSS	62	41
C#CCC(C)(C)C(=O)OCC(=O)CCCCCC	ZINC000784251464	CG	On-Demand	Mild	CQSS	51	33
C#CCOCCNC(=O)NCCCCC(=O)OC	ZINC000784256370	CC	On-Demand	Mild	EPHX2	15	49
CS[C@H](CNC(=O)NCC[C@@H](C)NC(=O)OC(C)(C)C)C(C)(C)C	ZINC000784288312	FG	On-Demand	Anodyne	CTSK	15	40
CS[C@H](CNC(=O)NCC[C@H](C)NC(=O)OC(C)(C)C)C(C)(C)C	ZINC000784288329	FG	On-Demand	Anodyne	CTSK	15	40
CCCCCCC(=O)COC(=O)[C@H](F)C(C)C	ZINC000784292980	BG	On-Demand	Anodyne	NOD1	56	33
CCCCCCC(=O)COC(=O)[C@H](F)C(C)C	ZINC000784292980	BG	On-Demand	Anodyne	CQSS	64	42
CCCCCCC(=O)COC(=O)[C@@H](F)C(C)C	ZINC000784292981	BG	On-Demand	Anodyne	NOD1	56	33
CCCCCCC(=O)COC(=O)[C@@H](F)C(C)C	ZINC000784292981	BG	On-Demand	Anodyne	CQSS	64	42
CCCCC[C@@H](C)NC(=O)COC(=O)[C@H](F)C(C)C	ZINC000784294958	CF	On-Demand	Anodyne	NOD1	84	36
CCCCC[C@@H](C)NC(=O)COC(=O)[C@@H](F)C(C)C	ZINC000784294962	CF	On-Demand	Anodyne	NOD1	84	36
COC(=O)[C@@H](CC(C)C)NC(=O)COC(=O)[C@@H](F)C(C)C	ZINC000784296011	DD	On-Demand	Anodyne	PGA	21	41
COC(=O)[C@@H](CC(C)C)NC(=O)COC(=O)[C@H](F)C(C)C	ZINC000784296013	DD	On-Demand	Anodyne	PGA	21	41
CCCCCNC(=O)[C@@H](C)OC(=O)[C@H](F)C(C)C	ZINC000784308244	CE	On-Demand	Anodyne	ASAH1	56	34
CCCCCNC(=O)[C@@H](C)OC(=O)[C@@H](F)C(C)C	ZINC000784308247	CE	On-Demand	Anodyne	ASAH1	56	34
CCCCCNC(=O)[C@H](C)OC(=O)[C@@H](F)C(C)C	ZINC000784308248	CE	On-Demand	Anodyne	ASAH1	56	34
CCCCCNC(=O)[C@H](C)OC(=O)[C@H](F)C(C)C	ZINC000784308250	CE	On-Demand	Anodyne	ASAH1	56	34
CCCCCNC(=O)COC(=O)[C@H](F)C(C)C	ZINC000784310116	BD	On-Demand	Anodyne	ASAH1	57	36
CCCCCNC(=O)COC(=O)[C@H](F)C(C)C	ZINC000784310116	BD	On-Demand	Anodyne	NOD1	56	38
CCCCCNC(=O)COC(=O)[C@@H](F)C(C)C	ZINC000784310117	BD	On-Demand	Anodyne	ASAH1	57	36
CCCCCNC(=O)COC(=O)[C@@H](F)C(C)C	ZINC000784310117	BD	On-Demand	Anodyne	NOD1	56	38
CCCCC[C@@H](C)NC(=O)COC(=O)C(C)(C)C(C)C	ZINC000784323283	CG	On-Demand	Anodyne	CELA2A	22	46
CCCCC[C@@H](C)NC(=O)COC(=O)C(C)(C)C(C)C	ZINC000784323283	CG	On-Demand	Anodyne	NOD1	84	35
COC(=O)[C@@H](CC(C)C)NC(=O)COC(=O)C(C)(C)C(C)C	ZINC000784326666	DD	On-Demand	Anodyne	PGA	24	45
CCCCCNC(=O)[C@@H](C)OC(=O)C(C)(C)C(C)C	ZINC000784329196	CF	On-Demand	Anodyne	ASAH1	42	33
CCCCCNC(=O)[C@H](C)OC(=O)C(C)(C)C(C)C	ZINC000784329198	CF	On-Demand	Anodyne	ASAH1	42	33
CCCCNC(=O)COC(=O)C(C)(C)C(C)C	ZINC000784330938	BE	On-Demand	Anodyne	NOD1	56	36
CCCCCNC(=O)COC(=O)C(C)(C)C(C)C	ZINC000784336636	CF	On-Demand	Anodyne	ASAH1	43	34
CCCCCNC(=O)COC(=O)C(C)(C)C(C)C	ZINC000784336636	CF	On-Demand	Anodyne	NOD1	56	38
CCN(CCCOC(=O)C(C)(C)C(C)C)CC(F)(F)F	ZINC000784336750	CG	On-Demand	Anodyne	AMY2	52	40
CCCCS(=O)(=O)NCCCCCCSC	ZINC000784374819	CF	On-Demand	Anodyne	RELA	23	51
COC[C@@H](C)OC(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C	ZINC000784388190	DC	On-Demand	Anodyne	ECE1	19	40
COC[C@@H](C)OC(=O)[C@@H](CC(N)=O)NC(=O)OC(C)(C)C	ZINC000784388193	DC	On-Demand	Anodyne	ECE1	19	40
CCCCCCCCNC(=O)NCCCC#N	ZINC000784389561	BF	On-Demand	Mild	EPHX2	25	57
CCCCCCCCNC(=O)NCCCC#N	ZINC000784389561	BF	On-Demand	Mild	ASAH1	90	35
CCCCCCCCNC(=O)NCCCC#N	ZINC000784389561	BF	On-Demand	Mild	CQSS	54	33
CCCCCCCCNC(=O)N[C@@H](C)C[S@@](C)=O	ZINC000784390374	CE	On-Demand	Mild	EPHX2	20	43
CCCCCCCCNC(=O)N[C@@H](C)C[S@@](C)=O	ZINC000784390374	CE	On-Demand	Mild	ASAH1	72	34
CCCCCCCCNC(=O)N[C@@H](C)C[S@@](C)=O	ZINC000784390374	CE	On-Demand	Mild	NOD1	44	38
CCCCCCCCNC(=O)N[C@@H](C)C[S@@](C)=O	ZINC000784390374	CE	On-Demand	Mild	CQSS	40	33
CCCCCCCCNC(=O)N[C@H](C)C[S@@](C)=O	ZINC000784390375	CE	On-Demand	Mild	EPHX2	20	43
CCCCCCCCNC(=O)N[C@H](C)C[S@@](C)=O	ZINC000784390375	CE	On-Demand	Mild	ASAH1	72	34
CCCCCCCCNC(=O)N[C@H](C)C[S@@](C)=O	ZINC000784390375	CE	On-Demand	Mild	NOD1	44	38
CCCCCCCCNC(=O)N[C@H](C)C[S@@](C)=O	ZINC000784390375	CE	On-Demand	Mild	CQSS	40	33
CCCCCCCCNC(=O)N[C@@H](C)C[S@](C)=O	ZINC000784390377	CE	On-Demand	Mild	EPHX2	20	43
CCCCCCCCNC(=O)N[C@@H](C)C[S@](C)=O	ZINC000784390377	CE	On-Demand	Mild	ASAH1	72	34
CCCCCCCCNC(=O)N[C@@H](C)C[S@](C)=O	ZINC000784390377	CE	On-Demand	Mild	NOD1	44	38
CCCCCCCCNC(=O)N[C@@H](C)C[S@](C)=O	ZINC000784390377	CE	On-Demand	Mild	CQSS	40	33
CCCCCCCCNC(=O)N[C@H](C)C[S@](C)=O	ZINC000784390378	CE	On-Demand	Mild	EPHX2	20	43
CCCCCCCCNC(=O)N[C@H](C)C[S@](C)=O	ZINC000784390378	CE	On-Demand	Mild	ASAH1	72	34
CCCCCCCCNC(=O)N[C@H](C)C[S@](C)=O	ZINC000784390378	CE	On-Demand	Mild	NOD1	44	38
CCCCCCCCNC(=O)N[C@H](C)C[S@](C)=O	ZINC000784390378	CE	On-Demand	Mild	CQSS	40	33
CCCCCCCCNC(=O)CC(C)(C)C#N	ZINC000784401055	BG	On-Demand	Mild	ASAH1	80	33
CCCCCCCCNC(=O)CC(C)(C)OC	ZINC000784402874	BG	On-Demand	Mild	EPHX2	15	43
CCCCCCCCNC(=O)CC(C)(C)OC	ZINC000784402874	BG	On-Demand	Mild	ASAH1	83	37
CC[C@@H](NC(=O)[C@H](F)C(C)C)C(=O)OC	ZINC000784429667	BD	On-Demand	Anodyne	NPR	15	42
CC[C@H](NC(=O)[C@H](F)C(C)C)C(=O)OC	ZINC000784429668	BD	On-Demand	Anodyne	NPR	15	42
CC[C@@H](NC(=O)[C@@H](F)C(C)C)C(=O)OC	ZINC000784429669	BD	On-Demand	Anodyne	NPR	15	42
CC[C@H](NC(=O)[C@@H](F)C(C)C)C(=O)OC	ZINC000784429670	BD	On-Demand	Anodyne	NPR	15	42
CCC[C@H](NC(=O)[C@H](F)C(C)C)C(=O)OC	ZINC000784461766	BD	On-Demand	Anodyne	NPR	18	43
CCC[C@H](NC(=O)[C@@H](F)C(C)C)C(=O)OC	ZINC000784461767	BD	On-Demand	Anodyne	NPR	18	43
CCC[C@@H](NC(=O)[C@H](F)C(C)C)C(=O)OC	ZINC000784461769	BD	On-Demand	Anodyne	NPR	18	43