CCCCCCCCC(=O)NCC=C(C)C	ZINC000791001814	BH	On-Demand	Mild	CES2	50	42
CCCCCCCCC(=O)NCC=C(C)C	ZINC000791001814	BH	On-Demand	Mild	CES1	31	42
CCCCCCCCC(=O)NCC=C(C)C	ZINC000791001814	BH	On-Demand	Mild	EST1_PIG	72	42
CCCCCCCCC(=O)NCC=C(C)C	ZINC000791001814	BH	On-Demand	Mild	CES2C	56	33
CCCCCCCCC(=O)NCC=C(C)C	ZINC000791001814	BH	On-Demand	Mild	FABP3	34	44
CCCCCCCCC(=O)NCC=C(C)C	ZINC000791001814	BH	On-Demand	Mild	FABP5	17	48
CCCCCCCCC(=O)NCC=C(C)C	ZINC000791001814	BH	On-Demand	Mild	PAO	35	42
CCCCCCCCC(=O)NCC=C(C)C	ZINC000791001814	BH	On-Demand	Mild	LASR	42	36
CCCCCCCCC(=O)NCC=C(C)C	ZINC000791001814	BH	On-Demand	Mild	NOD1	74	44
CCCCCCCCC(=O)NCC=C(C)C	ZINC000791001814	BH	On-Demand	Mild	CQSS	62	38
CC(=O)CCCCCCC(=O)NCCC=C(C)C	ZINC000791002799	CG	On-Demand	Anodyne	PAOX	46	42
CCCCCCC(=O)NCCC=C(C)C	ZINC000791003026	BG	On-Demand	Anodyne	CNR1	16	63
CCCCCCC(=O)NCCC=C(C)C	ZINC000791003026	BG	On-Demand	Anodyne	SELP	17	50
CCCCCCC(=O)NCCC=C(C)C	ZINC000791003026	BG	On-Demand	Anodyne	CES2	37	40
CCCCCCC(=O)NCCC=C(C)C	ZINC000791003026	BG	On-Demand	Anodyne	CES1	23	40
CCCCCCC(=O)NCCC=C(C)C	ZINC000791003026	BG	On-Demand	Anodyne	EST1_PIG	53	40
CCCCCCC(=O)NCCC=C(C)C	ZINC000791003026	BG	On-Demand	Anodyne	CES2C	45	35
CCCCCCC(=O)NCCC=C(C)C	ZINC000791003026	BG	On-Demand	Anodyne	FABP3	32	42
CCCCCCC(=O)NCCC=C(C)C	ZINC000791003026	BG	On-Demand	Anodyne	FABP5	15	42
CCCCCCC(=O)NCCC=C(C)C	ZINC000791003026	BG	On-Demand	Anodyne	LASR	40	35
CCCCCCC(=O)NCCC=C(C)C	ZINC000791003026	BG	On-Demand	Anodyne	NOD1	61	42
CCCCCCC(=O)NCCC=C(C)C	ZINC000791003026	BG	On-Demand	Anodyne	CQSS	59	36
CCCCC[C@@H](C)CC(=O)NCC=C(C)C	ZINC000791003267	BH	On-Demand	Anodyne	NOD1	63	38
CCCCCCCC(=O)NCCC=C(C)C	ZINC000791003892	BH	On-Demand	Mild	CNR1	16	63
CCCCCCCC(=O)NCCC=C(C)C	ZINC000791003892	BH	On-Demand	Mild	SELP	17	50
CCCCCCCC(=O)NCCC=C(C)C	ZINC000791003892	BH	On-Demand	Mild	CES2	37	40
CCCCCCCC(=O)NCCC=C(C)C	ZINC000791003892	BH	On-Demand	Mild	CES1	23	40
CCCCCCCC(=O)NCCC=C(C)C	ZINC000791003892	BH	On-Demand	Mild	EST1_PIG	53	40
CCCCCCCC(=O)NCCC=C(C)C	ZINC000791003892	BH	On-Demand	Mild	CES2C	45	35
CCCCCCCC(=O)NCCC=C(C)C	ZINC000791003892	BH	On-Demand	Mild	FABP3	32	42
CCCCCCCC(=O)NCCC=C(C)C	ZINC000791003892	BH	On-Demand	Mild	FABP5	15	42
CCCCCCCC(=O)NCCC=C(C)C	ZINC000791003892	BH	On-Demand	Mild	LASR	40	35
CCCCCCCC(=O)NCCC=C(C)C	ZINC000791003892	BH	On-Demand	Mild	NOD1	61	42
CCCCCCCC(=O)NCCC=C(C)C	ZINC000791003892	BH	On-Demand	Mild	CQSS	59	36
CC(=O)CCCCCCC(=O)NCC=C(C)C	ZINC000791006826	BF	On-Demand	Anodyne	PAOX	44	40
CC(=O)CCCCCCC(=O)NCC=C(C)C	ZINC000791006826	BF	On-Demand	Anodyne	PAO	36	43
CCCCSCC(=O)NCC=C(C)C	ZINC000791007623	BF	On-Demand	Anodyne	CES2	15	45
CCCCSCC(=O)NCC=C(C)C	ZINC000791007623	BF	On-Demand	Anodyne	CES1	20	49
CCCCSCC(=O)NCC=C(C)C	ZINC000791007623	BF	On-Demand	Anodyne	EST1_PIG	56	49
C#C[C@@H](CCC)NC(=O)NCCCCC	ZINC000791009649	BE	On-Demand	Mild	EPHX2	15	41
C#C[C@@H](CCC)NC(=O)NCCCCCC	ZINC000791009670	BF	On-Demand	Mild	EPHX2	20	43
C#C[C@@H](CCC)NC(=O)NCCCCCC	ZINC000791009670	BF	On-Demand	Mild	ASAH1	67	34
C#C[C@@H](CCC)NC(=O)NCCCCCC	ZINC000791009670	BF	On-Demand	Mild	NOD1	48	38
C#C[C@@H](CCC)NC(=O)NCCCCCC	ZINC000791009670	BF	On-Demand	Mild	CQSS	40	34
CCCCCCC(=O)NCC=C(C)C	ZINC000791011659	AG	On-Demand	Anodyne	CES2	50	42
CCCCCCC(=O)NCC=C(C)C	ZINC000791011659	AG	On-Demand	Anodyne	CES1	31	42
CCCCCCC(=O)NCC=C(C)C	ZINC000791011659	AG	On-Demand	Anodyne	EST1_PIG	72	42
CCCCCCC(=O)NCC=C(C)C	ZINC000791011659	AG	On-Demand	Anodyne	CES2C	56	33
CCCCCCC(=O)NCC=C(C)C	ZINC000791011659	AG	On-Demand	Anodyne	FABP3	34	44
CCCCCCC(=O)NCC=C(C)C	ZINC000791011659	AG	On-Demand	Anodyne	FABP5	17	48
CCCCCCC(=O)NCC=C(C)C	ZINC000791011659	AG	On-Demand	Anodyne	PAO	35	42
CCCCCCC(=O)NCC=C(C)C	ZINC000791011659	AG	On-Demand	Anodyne	LASR	42	36
CCCCCCC(=O)NCC=C(C)C	ZINC000791011659	AG	On-Demand	Anodyne	NOD1	74	44
CCCCCCC(=O)NCC=C(C)C	ZINC000791011659	AG	On-Demand	Anodyne	CQSS	62	38
C#C[C@@H](CCC)NC(=O)NC[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000791032861	DE	On-Demand	Mild	PAPA1_CARPA	26	42
C#C[C@@H](CCC)NC(=O)NC[C@H](C)CNC(=O)OC(C)(C)C	ZINC000791032863	DE	On-Demand	Mild	PAPA1_CARPA	26	42
CCCCCCCC(=O)N[C@@H](C(C)C)C(C)(C)O	ZINC000791049984	CG	On-Demand	Mild	LASR	41	39
CCCCCCCC(=O)N[C@@H](C(C)C)C(C)(C)O	ZINC000791049984	CG	On-Demand	Mild	NOD1	102	50
CCCCCCCC(=O)N[C@@H](C(C)C)C(C)(C)O	ZINC000791049984	CG	On-Demand	Mild	CQSS	64	46
CCCCSCC(=O)N[C@@H](C(C)C)C(C)(C)O	ZINC000791050229	CE	On-Demand	Anodyne	CES1	18	44
CCCCSCC(=O)N[C@@H](C(C)C)C(C)(C)O	ZINC000791050229	CE	On-Demand	Anodyne	EST1_PIG	50	44
CC(=O)CCCCCCC(=O)N[C@@H](C(C)C)C(C)(C)O	ZINC000791050479	CF	On-Demand	Anodyne	PAOX	40	35
CC(=O)CCCCCCC(=O)N[C@@H](C(C)C)C(C)(C)O	ZINC000791050479	CF	On-Demand	Anodyne	NOD1	43	36
CCCCCCCCCN(C)C(=O)N[C@@H](C)C(=O)N(C)C	ZINC000791052159	CF	On-Demand	Mild	CQSS	51	33
CCCCCCCCC(=O)N[C@@H](C(C)C)C(C)(C)O	ZINC000791052606	CH	On-Demand	Mild	LASR	41	39
CCCCCCCCC(=O)N[C@@H](C(C)C)C(C)(C)O	ZINC000791052606	CH	On-Demand	Mild	NOD1	102	50
CCCCCCCCC(=O)N[C@@H](C(C)C)C(C)(C)O	ZINC000791052606	CH	On-Demand	Mild	CQSS	64	46
CCCCC[C@@H](C)CC(=O)N[C@@H](C(C)C)C(C)(C)O	ZINC000791052630	CH	On-Demand	Anodyne	NOD1	54	34
CCCCCCC(=O)N[C@@H](C(C)C)C(C)(C)O	ZINC000791054323	BF	On-Demand	Anodyne	LASR	41	39
CCCCCCC(=O)N[C@@H](C(C)C)C(C)(C)O	ZINC000791054323	BF	On-Demand	Anodyne	NOD1	102	50
CCCCCCC(=O)N[C@@H](C(C)C)C(C)(C)O	ZINC000791054323	BF	On-Demand	Anodyne	CQSS	64	46
CCCCCCCCCNC(=O)N[C@@H](C)C(=O)N(C)C	ZINC000791055117	CF	On-Demand	Mild	PDF	41	35
CCCCCCCCCNC(=O)N[C@@H](C)C(=O)N(C)C	ZINC000791055117	CF	On-Demand	Mild	EPHX2	20	42
CCCCCCCCCNC(=O)N[C@@H](C)C(=O)N(C)C	ZINC000791055117	CF	On-Demand	Mild	ASAH1	81	35
CCCCCCCCCNC(=O)N[C@@H](C)C(=O)N(C)C	ZINC000791055117	CF	On-Demand	Mild	NOD1	44	36
CCCCCCCCCNC(=O)N[C@@H](C)C(=O)N(C)C	ZINC000791055117	CF	On-Demand	Mild	CQSS	50	33
C[C@H](CC(=O)NCCCCCO)NC(=O)OC(C)(C)C	ZINC000791057995	CD	On-Demand	Anodyne	CTSK	16	45
C[C@H](CC(=O)NCCCCCO)NC(=O)OC(C)(C)C	ZINC000791057995	CD	On-Demand	Anodyne	ECE1	24	56
C[C@@H](CC(=O)NCCCCCO)NC(=O)OC(C)(C)C	ZINC000791057996	CD	On-Demand	Anodyne	CTSK	16	45
C[C@@H](CC(=O)NCCCCCO)NC(=O)OC(C)(C)C	ZINC000791057996	CD	On-Demand	Anodyne	ECE1	24	56
C#C[C@@H](CCC)NC(=O)NC[C@H](NC(=O)OC(C)(C)C)C(C)C	ZINC000791067555	EF	On-Demand	Mild	PAPA1_CARPA	22	43
C#C[C@@H](CCC)NC(=O)NC[C@H](NC(=O)OC(C)(C)C)C(C)C	ZINC000791067555	EF	On-Demand	Mild	CTSK	16	42
C#C[C@@H](CCC)NC(=O)NC[C@H](NC(=O)OC(C)(C)C)C(C)C	ZINC000791067555	EF	On-Demand	Mild	PGA5	23	41
C#C[C@@H](CCC)NC(=O)NC[C@@H](NC(=O)OC(C)(C)C)C(C)C	ZINC000791067557	EF	On-Demand	Mild	PAPA1_CARPA	22	43
C#C[C@@H](CCC)NC(=O)NC[C@@H](NC(=O)OC(C)(C)C)C(C)C	ZINC000791067557	EF	On-Demand	Mild	CTSK	16	42
C#C[C@@H](CCC)NC(=O)NC[C@@H](NC(=O)OC(C)(C)C)C(C)C	ZINC000791067557	EF	On-Demand	Mild	PGA5	23	41
CCCC[C@@H](NC(N)=O)C(=O)NCCSSC	ZINC000791094049	CD	On-Demand	Reactive	NOD1	46	33
CCCC[C@H](NC(N)=O)C(=O)NCCSSC	ZINC000791094051	CD	On-Demand	Reactive	NOD1	46	33
CCCC[C@H](NC(=O)NCC)C(=O)NCCSSC	ZINC000791099271	DD	On-Demand	Reactive	NOD1	41	33
CCCC[C@@H](NC(=O)NCC)C(=O)NCCSSC	ZINC000791099277	DD	On-Demand	Reactive	NOD1	41	33
COCC(=O)N[C@H](C(=O)NCCSSC)C(C)C	ZINC000791100838	CC	On-Demand	Reactive	PGA	42	34
C#CCCS(=O)(=O)NC(=O)CCCCC	ZINC000791110535	BD	On-Demand	Mild	CQSS	49	30
CC#CCS(=O)(=O)NC(=O)CCCCC	ZINC000791111029	BD	On-Demand	Mild	CQSS	50	31
CCCC[C@@H](C)C(=O)NCCSSC	ZINC000791113888	BF	On-Demand	Reactive	NOD1	46	34
CCCC[C@H](C)C(=O)NCCSSC	ZINC000791113889	BF	On-Demand	Reactive	NOD1	46	34
CCCCCCC(=O)N(CCC(F)(F)F)CC(F)(F)F	ZINC000791116488	DI	On-Demand	Anodyne	CES2	54	44
CCCCCCC(=O)N(CCC(F)(F)F)CC(F)(F)F	ZINC000791116488	DI	On-Demand	Anodyne	CES1	53	44
CCCCCCC(=O)N(CCC(F)(F)F)CC(F)(F)F	ZINC000791116488	DI	On-Demand	Anodyne	EST1_PIG	77	44
CCCCCCC(=O)N(CCC(F)(F)F)CC(F)(F)F	ZINC000791116488	DI	On-Demand	Anodyne	CES2C	62	39
CCCCCCC(=O)N(CCC(F)(F)F)CC(F)(F)F	ZINC000791116488	DI	On-Demand	Anodyne	CQSS	54	33
CCCCSCC(=O)N(CCC(F)(F)F)CC(F)(F)F	ZINC000791117070	EH	On-Demand	Anodyne	CES2	31	48
CCCCSCC(=O)N(CCC(F)(F)F)CC(F)(F)F	ZINC000791117070	EH	On-Demand	Anodyne	CES1	29	51
CCCCSCC(=O)N(CCC(F)(F)F)CC(F)(F)F	ZINC000791117070	EH	On-Demand	Anodyne	EST1_PIG	66	51
CCCCSCC(=O)N(CCC(F)(F)F)CC(F)(F)F	ZINC000791117070	EH	On-Demand	Anodyne	CES2C	31	48
C[C@H](NC(=O)OC(C)(C)C)[C@H](C)C(=O)N(CCC(F)(F)F)CC(F)(F)F	ZINC000791119587	GH	On-Demand	Anodyne	CTSK	15	48
C[C@H](C(=O)N(CCC(F)(F)F)CC(F)(F)F)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000791119596	GH	On-Demand	Anodyne	CTSK	15	48
C=CCN(CC=C)C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C	ZINC000791125016	DG	On-Demand	Mild	PDF	76	37
C=CCN(CC=C)C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C	ZINC000791125016	DG	On-Demand	Mild	CTSK	19	45
CCCC[C@@H](CC)C(=O)N(CC(=O)N(C)C)CC(F)(F)F	ZINC000791128426	DF	On-Demand	Anodyne	PDF	40	37
CCCC[C@H](CC)C(=O)N(CC(=O)N(C)C)CC(F)(F)F	ZINC000791128427	DF	On-Demand	Anodyne	PDF	40	37
CCCC[C@@H](CC)C(=O)NC(C)(C)CNC(=O)OC(C)(C)C	ZINC000791128439	DH	On-Demand	Anodyne	CTSK	20	47
CCCC[C@@H](CC)C(=O)NC(C)(C)CNC(=O)OC(C)(C)C	ZINC000791128439	DH	On-Demand	Anodyne	PGA5	23	43
CCCC[C@H](CC)C(=O)NC(C)(C)CNC(=O)OC(C)(C)C	ZINC000791128441	DH	On-Demand	Anodyne	CTSK	20	47
CCCC[C@H](CC)C(=O)NC(C)(C)CNC(=O)OC(C)(C)C	ZINC000791128441	DH	On-Demand	Anodyne	PGA5	23	43
CCCC[C@H](CC)C(=O)N[C@@H](CN(C)C)C(C)C	ZINC000791129009	CF	On-Demand	Anodyne	PDF	77	45
CCCC[C@@H](CC)C(=O)N[C@@H](CN(C)C)C(C)C	ZINC000791129014	CF	On-Demand	Anodyne	PDF	77	45
CCCC[C@H](CC)C(=O)N[C@H](CN(C)C)C(C)C	ZINC000791129015	CF	On-Demand	Anodyne	PDF	77	45
CCCC[C@@H](CC)C(=O)N[C@H](CN(C)C)C(C)C	ZINC000791129017	CF	On-Demand	Anodyne	PDF	77	45
CCCC[C@H](CC)C(=O)N(C)[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000791130115	DH	On-Demand	Anodyne	CTSK	21	44
CCCC[C@H](CC)C(=O)N(C)[C@H](C)CNC(=O)OC(C)(C)C	ZINC000791130116	DH	On-Demand	Anodyne	CTSK	21	44
CCCC[C@@H](CC)C(=O)N(C)[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000791130118	DH	On-Demand	Anodyne	CTSK	21	44
CCCC[C@@H](CC)C(=O)N(C)[C@H](C)CNC(=O)OC(C)(C)C	ZINC000791130119	DH	On-Demand	Anodyne	CTSK	21	44
CCCC[C@@H](CC)C(=O)N[C@H](C(=O)OCC)C(C)(C)C	ZINC000791133294	CG	On-Demand	Anodyne	PDF	102	52
CCCC[C@@H](CC)C(=O)N[C@H](C(=O)OCC)C(C)(C)C	ZINC000791133294	CG	On-Demand	Anodyne	MMP2	18	49
CCCC[C@@H](CC)C(=O)N[C@H](C(=O)OCC)C(C)(C)C	ZINC000791133294	CG	On-Demand	Anodyne	MMP3	33	46
CCCC[C@H](CC)C(=O)N[C@H](C(=O)OCC)C(C)(C)C	ZINC000791133295	CG	On-Demand	Anodyne	PDF	102	52
CCCC[C@H](CC)C(=O)N[C@H](C(=O)OCC)C(C)(C)C	ZINC000791133295	CG	On-Demand	Anodyne	MMP2	18	49
CCCC[C@H](CC)C(=O)N[C@H](C(=O)OCC)C(C)(C)C	ZINC000791133295	CG	On-Demand	Anodyne	MMP3	33	46
CCCCCCC(=O)NCCSSC	ZINC000791150212	BG	On-Demand	Reactive	NOD1	60	41
CCCCCCC(=O)NCCSSC	ZINC000791150212	BG	On-Demand	Reactive	CQSS	57	35
CCCCCCCC(=O)NCCSSC	ZINC000791150680	BG	On-Demand	Reactive	NOD1	60	41
CCCCCCCC(=O)NCCSSC	ZINC000791150680	BG	On-Demand	Reactive	CQSS	57	35
CCCCSCC(=O)NCCSSC	ZINC000791151837	CF	On-Demand	Reactive	CES1	18	43
CCCCSCC(=O)NCCSSC	ZINC000791151837	CF	On-Demand	Reactive	EST1_PIG	50	43
C[C@@H](CC(=O)N(CCC(F)(F)F)CC(F)(F)F)NC(=O)OC(C)(C)C	ZINC000791154164	GH	On-Demand	Anodyne	CTSK	15	47
CCCCSCCC(=O)NCCSSC	ZINC000791155728	CG	On-Demand	Reactive	EST1_PIG	40	35
CCCCCS(=O)(=O)CC(=O)NCCSSC	ZINC000791155775	CD	On-Demand	Reactive	EST1_PIG	25	42
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N(CCC(F)(F)F)CC(F)(F)F	ZINC000791156749	GH	On-Demand	Anodyne	CTSK	16	47
C[C@H](NC(=O)OC(C)(C)C)C(=O)N(CCC(F)(F)F)CC(F)(F)F	ZINC000791157393	FG	On-Demand	Anodyne	CTSK	17	49
C#C[C@@H](CCC)NC(=O)[C@@H](CC)CCCCC	ZINC000791197443	BH	On-Demand	Mild	PDF	50	36
C#C[C@@H](CCC)NC(=O)[C@@H](CC)CCCCC	ZINC000791197443	BH	On-Demand	Mild	CQSS	41	32
C#C[C@@H](CCC)NC(=O)[C@H](CC)CCCCC	ZINC000791197444	BH	On-Demand	Mild	PDF	50	36
C#C[C@@H](CCC)NC(=O)[C@H](CC)CCCCC	ZINC000791197444	BH	On-Demand	Mild	CQSS	41	32
C#C[C@@H](CCC)NC(=O)[C@H](NC(=O)OC)C(C)C	ZINC000791200806	CD	On-Demand	Mild	PGA	57	41
C#C[C@@H](CCC)NC(=O)[C@H](NC(=O)OC)C(C)C	ZINC000791200806	CD	On-Demand	Mild	PGA5	38	44
C#C[C@@H](CCC)NC(=O)CCCC[C@@H](C)CC	ZINC000791201184	BH	On-Demand	Mild	NOD1	68	39
C#C[C@@H](CCC)NC(=O)CCCC[C@H](C)CC	ZINC000791201185	BH	On-Demand	Mild	NOD1	68	39
C#C[C@H](CCC)NC(=O)CCCC[C@@H](C)CC	ZINC000791201186	BH	On-Demand	Mild	NOD1	68	39
C#C[C@H](CCC)NC(=O)CCCC[C@H](C)CC	ZINC000791201187	BH	On-Demand	Mild	NOD1	68	39
C#C[C@H](CCC)NC(=O)C[C@H](C)CC(C)C	ZINC000791201540	BF	On-Demand	Mild	PGA	49	37
C#C[C@@H](CCC)NC(=O)C[C@H](C)CC(C)C	ZINC000791201541	BF	On-Demand	Mild	PGA	49	37
C#C[C@H](CCC)NC(=O)C[C@@H](C)CC(C)C	ZINC000791201542	BF	On-Demand	Mild	PGA	49	37
C#C[C@@H](CCC)NC(=O)C[C@@H](C)CC(C)C	ZINC000791201543	BF	On-Demand	Mild	PGA	49	37
C#C[C@@H](CCC)NC(=O)C[C@@H](C)CCCCC	ZINC000791202890	BH	On-Demand	Mild	NOD1	47	34
C#C[C@@H](CCC)NC(=O)C[C@H](C)CCCCC	ZINC000791202891	BH	On-Demand	Mild	NOD1	47	34
C#C[C@H](CCC)NC(=O)C[C@@H](C)CCCCC	ZINC000791202892	BH	On-Demand	Mild	NOD1	47	34
C#C[C@H](CCC)NC(=O)C[C@H](C)CCCCC	ZINC000791202893	BH	On-Demand	Mild	NOD1	47	34
C[C@H](NC(=O)OC(C)(C)C)C(=O)NC[C@H](O)C(N)=O	ZINC000791254984	CA	On-Demand	Anodyne	CTSD	20	41
C[C@H](NC(=O)OC(C)(C)C)C(=O)NC[C@H](O)C(N)=O	ZINC000791254984	CA	On-Demand	Anodyne	CTSK	15	42
C[C@H](NC(=O)OC(C)(C)C)C(=O)NC[C@H](O)C(N)=O	ZINC000791254984	CA	On-Demand	Anodyne	PGA	22	41
C[C@H](NC(=O)OC(C)(C)C)C(=O)NC[C@H](O)C(N)=O	ZINC000791254984	CA	On-Demand	Anodyne	ECE1	32	42
C[C@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H](O)C(N)=O	ZINC000791254985	CA	On-Demand	Anodyne	CTSD	20	41
C[C@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H](O)C(N)=O	ZINC000791254985	CA	On-Demand	Anodyne	CTSK	15	42
C[C@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H](O)C(N)=O	ZINC000791254985	CA	On-Demand	Anodyne	PGA	22	41
C[C@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H](O)C(N)=O	ZINC000791254985	CA	On-Demand	Anodyne	ECE1	32	42
CCCCC[C@@H](C)NC(=O)/C=C\COC	ZINC000791317785	BE	On-Demand	Anodyne	NOD1	47	35
CCCCC[C@@H](C)NC(=O)/C=C/COC	ZINC000791317787	BE	On-Demand	Anodyne	NOD1	47	35
C=C(CO)C(=O)N[C@@H](C)CCCCC	ZINC000791318252	AD	On-Demand	Mild	CQSS	40	32
C=C(CO)C(=O)N[C@H](C)CCCCC	ZINC000791318253	AD	On-Demand	Mild	CQSS	40	32
CCCCN(CC(N)=O)C(=O)[C@@H](F)C(F)(F)F	ZINC000791322122	CD	On-Demand	Anodyne	CES2	45	33
CCCCN(CC(N)=O)C(=O)[C@@H](F)C(F)(F)F	ZINC000791322122	CD	On-Demand	Anodyne	EST1_PIG	60	33
CCCCN(CC(N)=O)C(=O)[C@@H](F)C(F)(F)F	ZINC000791322122	CD	On-Demand	Anodyne	CES2C	52	32
CCCCN(CC(N)=O)C(=O)[C@H](F)C(F)(F)F	ZINC000791322123	CD	On-Demand	Anodyne	CES2	45	33
CCCCN(CC(N)=O)C(=O)[C@H](F)C(F)(F)F	ZINC000791322123	CD	On-Demand	Anodyne	EST1_PIG	60	33
CCCCN(CC(N)=O)C(=O)[C@H](F)C(F)(F)F	ZINC000791322123	CD	On-Demand	Anodyne	CES2C	52	32
C=C(CO)C(=O)N(CCCC)CC(F)(F)F	ZINC000791333627	BD	On-Demand	Mild	EST1_PIG	45	33
C=CCN(CCOC)C(=O)CSCCCC	ZINC000791345553	BE	On-Demand	Mild	EST1_PIG	42	36
C=CCN(CCOC)C(=O)C[C@@H](C)NC(=O)OC(C)(C)C	ZINC000791350329	DD	On-Demand	Mild	CTSK	15	46
C=CCN(CCOC)C(=O)C[C@H](C)NC(=O)OC(C)(C)C	ZINC000791350330	DD	On-Demand	Mild	CTSK	15	46
C=CCN(CCOC)C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C	ZINC000791353911	EF	On-Demand	Mild	CTSK	15	47
C=C(CO)C(=O)N[C@H](C)CCN(C)C	ZINC000791364908	BB	On-Demand	Mild	UTS2	40	33
C=C(CO)C(=O)N[C@@H](C)CCN(C)C	ZINC000791364914	BB	On-Demand	Mild	UTS2	40	33
CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)NCC(F)(F)C(F)F	ZINC000791401590	FD	On-Demand	Anodyne	PAPA1_CARPA	33	40
CCCCSCC(=O)NCC(F)(F)C(F)F	ZINC000791403529	CF	On-Demand	Anodyne	CES2	25	48
CCCCSCC(=O)NCC(F)(F)C(F)F	ZINC000791403529	CF	On-Demand	Anodyne	CES1	29	51
CCCCSCC(=O)NCC(F)(F)C(F)F	ZINC000791403529	CF	On-Demand	Anodyne	EST1_PIG	66	51
CCCCSCC(=O)NCC(F)(F)C(F)F	ZINC000791403529	CF	On-Demand	Anodyne	CES2C	22	48
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)NCC(F)(F)C(F)F	ZINC000791403903	FF	On-Demand	Anodyne	PAPA1_CARPA	42	44
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)NCC(F)(F)C(F)F	ZINC000791403903	FF	On-Demand	Anodyne	CTSK	18	50
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)NCC(F)(F)C(F)F	ZINC000791403903	FF	On-Demand	Anodyne	POLG_HCV1	34	52
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)NCC(F)(F)C(F)F	ZINC000791403903	FF	On-Demand	Anodyne	SCN10A	15	40
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)NCC(F)(F)C(F)F	ZINC000791403903	FF	On-Demand	Anodyne	FPR1	46	35
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)NCC(F)(F)C(F)F	ZINC000791403905	FF	On-Demand	Anodyne	PAPA1_CARPA	42	44
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)NCC(F)(F)C(F)F	ZINC000791403905	FF	On-Demand	Anodyne	CTSK	18	50
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)NCC(F)(F)C(F)F	ZINC000791403905	FF	On-Demand	Anodyne	POLG_HCV1	34	52
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)NCC(F)(F)C(F)F	ZINC000791403905	FF	On-Demand	Anodyne	SCN10A	15	40
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)NCC(F)(F)C(F)F	ZINC000791403905	FF	On-Demand	Anodyne	FPR1	46	35
CCCCCC[C@](C)(CC)C(=O)NCC(F)(F)C(F)F	ZINC000791404454	CI	On-Demand	Anodyne	CES2	48	39
CCCCCC[C@](C)(CC)C(=O)NCC(F)(F)C(F)F	ZINC000791404454	CI	On-Demand	Anodyne	EST1_PIG	62	33
CCCCCC[C@](C)(CC)C(=O)NCC(F)(F)C(F)F	ZINC000791404454	CI	On-Demand	Anodyne	CES2C	56	39
CC(=O)CCCCCCC(=O)NCC(F)(F)C(F)F	ZINC000791414940	CF	On-Demand	Anodyne	PAOX	40	38
C#CCCCS(=O)(=O)NCCCNS(=O)(=O)CC	ZINC000791420773	CB	On-Demand	Mild	RELA	19	43
C#CCCS(=O)(=O)NCCCNS(=O)(=O)CC	ZINC000791421790	CB	On-Demand	Mild	RELA	19	43
CCCCC[C@@H](C)NC(=O)C(C)(C)C(F)F	ZINC000791448364	BG	On-Demand	Anodyne	CELA2A	17	41
CC(=O)N[C@@H](C(=O)OC[C@H](C)O)C(C)C	ZINC000791482385	BC	On-Demand	Anodyne	PAPA1_CARPA	24	40
CC(=O)N[C@@H](C(=O)OC[C@@H](C)O)C(C)C	ZINC000791482387	BC	On-Demand	Anodyne	PAPA1_CARPA	24	40
CC(=O)CCC(=O)OCCCN(C)C	ZINC000791494763	BC	On-Demand	Anodyne	PAOX	25	44