C#CCN(CC#CC)C(=O)CCCCCCCC	ZINC000742003460	BG	On-Demand	Mild	CQSS	53	33
C#CCN(CC#CC)C(=O)CCCCCC	ZINC000742004110	BE	On-Demand	Mild	CQSS	53	33
C#CCN(CC#CC)C(=O)CSCCCC	ZINC000742004554	BE	On-Demand	Mild	EST1_PIG	44	38
C#CCN(CC#CC)C(=O)CCCCCCC	ZINC000742004946	BF	On-Demand	Mild	CQSS	53	33
C=CCNC(=O)[C@H](C)CCCCCC	ZINC000742032410	AF	On-Demand	Mild	NOD1	92	43
C=CCNC(=O)[C@H](C)CCCCCC	ZINC000742032410	AF	On-Demand	Mild	CQSS	53	34
C=CCNC(=O)[C@@H](C)CCCCCC	ZINC000742032411	AF	On-Demand	Mild	NOD1	92	43
C=CCNC(=O)[C@@H](C)CCCCCC	ZINC000742032411	AF	On-Demand	Mild	CQSS	53	34
CCCCCCCCCNC(=O)C(C)(C)NS(C)(=O)=O	ZINC000742044285	DE	On-Demand	Mild	CES2	33	41
CCCCCCCCCNC(=O)C(C)(C)NS(C)(=O)=O	ZINC000742044285	DE	On-Demand	Mild	EST1_PIG	37	41
CCCCCCCCCNC(=O)C(C)(C)NS(C)(=O)=O	ZINC000742044285	DE	On-Demand	Mild	CES2C	40	41
CCCCCCCCCNC(=O)C(C)(C)NS(C)(=O)=O	ZINC000742044285	DE	On-Demand	Mild	ASAH1	94	37
C[C@@H](CCNC(=O)C(C)(C)NS(C)(=O)=O)NC(=O)OC(C)(C)C	ZINC000742059999	FC	On-Demand	Anodyne	CTSK	15	43
C#CC(C)(C)NC(=O)[C@H](C)CCCCCC	ZINC000742077031	BG	On-Demand	Mild	NOD1	74	38
C#CC(C)(C)NC(=O)[C@H](C)CCCCCC	ZINC000742077031	BG	On-Demand	Mild	CQSS	51	33
C#CC(C)(C)NC(=O)[C@@H](C)CCCCCC	ZINC000742077034	BG	On-Demand	Mild	NOD1	74	38
C#CC(C)(C)NC(=O)[C@@H](C)CCCCCC	ZINC000742077034	BG	On-Demand	Mild	CQSS	51	33
C=C(Cl)CNC(=O)[C@@H](C)CCCCCC	ZINC000742080086	BG	On-Demand	Mild	NOD1	85	39
C=C(Cl)CNC(=O)[C@@H](C)CCCCCC	ZINC000742080086	BG	On-Demand	Mild	CQSS	52	33
C=C(Cl)CNC(=O)[C@H](C)CCCCCC	ZINC000742080087	BG	On-Demand	Mild	NOD1	85	39
C=C(Cl)CNC(=O)[C@H](C)CCCCCC	ZINC000742080087	BG	On-Demand	Mild	CQSS	52	33
C#CCN(CC#CC)C(=O)[C@H](CCC)NC(=O)OC(C)(C)C	ZINC000742130671	DE	On-Demand	Mild	PAPA1_CARPA	35	51
C#CCN(CC#CC)C(=O)[C@H](CCC)NC(=O)OC(C)(C)C	ZINC000742130671	DE	On-Demand	Mild	CTSK	18	45
C#CCN(CC#CC)C(=O)[C@@H](CCC)NC(=O)OC(C)(C)C	ZINC000742130672	DE	On-Demand	Mild	PAPA1_CARPA	35	51
C#CCN(CC#CC)C(=O)[C@@H](CCC)NC(=O)OC(C)(C)C	ZINC000742130672	DE	On-Demand	Mild	CTSK	18	45
COC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)CC(N)=O	ZINC000742183888	CC	On-Demand	Anodyne	KLK3	77	46
COC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)CC(N)=O	ZINC000742183888	CC	On-Demand	Anodyne	CTSB	44	43
COC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)CC(N)=O	ZINC000742183888	CC	On-Demand	Anodyne	PAPA1_CARPA	57	39
COC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)CC(N)=O	ZINC000742183888	CC	On-Demand	Anodyne	CTSK	31	46
COC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)CC(N)=O	ZINC000742183888	CC	On-Demand	Anodyne	HLA-A	46	39
COC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)CC(N)=O	ZINC000742183888	CC	On-Demand	Anodyne	CAPNS1	66	41
COC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)CC(N)=O	ZINC000742183888	CC	On-Demand	Anodyne	HLA-DRB1	65	37
COC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)CC(N)=O	ZINC000742183888	CC	On-Demand	Anodyne	CAPN1	101	57
COC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)CC(N)=O	ZINC000742183888	CC	On-Demand	Anodyne	CAPN2	132	45
COC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)CC(N)=O	ZINC000742183888	CC	On-Demand	Anodyne	FPR1	52	38
COC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)CC(N)=O	ZINC000742183888	CC	On-Demand	Anodyne	NPR	74	38
COC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)CC(N)=O	ZINC000742183888	CC	On-Demand	Anodyne	PSMB5	15	43
COC(=O)N[C@H](CC(C)C)C(=O)N[C@@H](C)CC(N)=O	ZINC000742183889	CC	On-Demand	Anodyne	KLK3	77	46
COC(=O)N[C@H](CC(C)C)C(=O)N[C@@H](C)CC(N)=O	ZINC000742183889	CC	On-Demand	Anodyne	CTSB	44	43
COC(=O)N[C@H](CC(C)C)C(=O)N[C@@H](C)CC(N)=O	ZINC000742183889	CC	On-Demand	Anodyne	PAPA1_CARPA	57	39
COC(=O)N[C@H](CC(C)C)C(=O)N[C@@H](C)CC(N)=O	ZINC000742183889	CC	On-Demand	Anodyne	CTSK	31	46
COC(=O)N[C@H](CC(C)C)C(=O)N[C@@H](C)CC(N)=O	ZINC000742183889	CC	On-Demand	Anodyne	HLA-A	46	39
COC(=O)N[C@H](CC(C)C)C(=O)N[C@@H](C)CC(N)=O	ZINC000742183889	CC	On-Demand	Anodyne	CAPNS1	66	41
COC(=O)N[C@H](CC(C)C)C(=O)N[C@@H](C)CC(N)=O	ZINC000742183889	CC	On-Demand	Anodyne	HLA-DRB1	65	37
COC(=O)N[C@H](CC(C)C)C(=O)N[C@@H](C)CC(N)=O	ZINC000742183889	CC	On-Demand	Anodyne	CAPN1	101	57
COC(=O)N[C@H](CC(C)C)C(=O)N[C@@H](C)CC(N)=O	ZINC000742183889	CC	On-Demand	Anodyne	CAPN2	132	45
COC(=O)N[C@H](CC(C)C)C(=O)N[C@@H](C)CC(N)=O	ZINC000742183889	CC	On-Demand	Anodyne	FPR1	52	38
COC(=O)N[C@H](CC(C)C)C(=O)N[C@@H](C)CC(N)=O	ZINC000742183889	CC	On-Demand	Anodyne	NPR	74	38
COC(=O)N[C@H](CC(C)C)C(=O)N[C@@H](C)CC(N)=O	ZINC000742183889	CC	On-Demand	Anodyne	PSMB5	15	43
COC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)CC(N)=O	ZINC000742183890	CC	On-Demand	Anodyne	KLK3	77	46
COC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)CC(N)=O	ZINC000742183890	CC	On-Demand	Anodyne	CTSB	44	43
COC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)CC(N)=O	ZINC000742183890	CC	On-Demand	Anodyne	PAPA1_CARPA	57	39
COC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)CC(N)=O	ZINC000742183890	CC	On-Demand	Anodyne	CTSK	31	46
COC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)CC(N)=O	ZINC000742183890	CC	On-Demand	Anodyne	HLA-A	46	39
COC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)CC(N)=O	ZINC000742183890	CC	On-Demand	Anodyne	CAPNS1	66	41
COC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)CC(N)=O	ZINC000742183890	CC	On-Demand	Anodyne	HLA-DRB1	65	37
COC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)CC(N)=O	ZINC000742183890	CC	On-Demand	Anodyne	CAPN1	101	57
COC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)CC(N)=O	ZINC000742183890	CC	On-Demand	Anodyne	CAPN2	132	45
COC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)CC(N)=O	ZINC000742183890	CC	On-Demand	Anodyne	FPR1	52	38
COC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)CC(N)=O	ZINC000742183890	CC	On-Demand	Anodyne	NPR	74	38
COC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)CC(N)=O	ZINC000742183890	CC	On-Demand	Anodyne	PSMB5	15	43
COC(=O)N[C@H](CC(C)C)C(=O)N[C@H](C)CC(N)=O	ZINC000742183891	CC	On-Demand	Anodyne	KLK3	77	46
COC(=O)N[C@H](CC(C)C)C(=O)N[C@H](C)CC(N)=O	ZINC000742183891	CC	On-Demand	Anodyne	CTSB	44	43
COC(=O)N[C@H](CC(C)C)C(=O)N[C@H](C)CC(N)=O	ZINC000742183891	CC	On-Demand	Anodyne	PAPA1_CARPA	57	39
COC(=O)N[C@H](CC(C)C)C(=O)N[C@H](C)CC(N)=O	ZINC000742183891	CC	On-Demand	Anodyne	CTSK	31	46
COC(=O)N[C@H](CC(C)C)C(=O)N[C@H](C)CC(N)=O	ZINC000742183891	CC	On-Demand	Anodyne	HLA-A	46	39
COC(=O)N[C@H](CC(C)C)C(=O)N[C@H](C)CC(N)=O	ZINC000742183891	CC	On-Demand	Anodyne	CAPNS1	66	41
COC(=O)N[C@H](CC(C)C)C(=O)N[C@H](C)CC(N)=O	ZINC000742183891	CC	On-Demand	Anodyne	HLA-DRB1	65	37
COC(=O)N[C@H](CC(C)C)C(=O)N[C@H](C)CC(N)=O	ZINC000742183891	CC	On-Demand	Anodyne	CAPN1	101	57
COC(=O)N[C@H](CC(C)C)C(=O)N[C@H](C)CC(N)=O	ZINC000742183891	CC	On-Demand	Anodyne	CAPN2	132	45
COC(=O)N[C@H](CC(C)C)C(=O)N[C@H](C)CC(N)=O	ZINC000742183891	CC	On-Demand	Anodyne	FPR1	52	38
COC(=O)N[C@H](CC(C)C)C(=O)N[C@H](C)CC(N)=O	ZINC000742183891	CC	On-Demand	Anodyne	NPR	74	38
COC(=O)N[C@H](CC(C)C)C(=O)N[C@H](C)CC(N)=O	ZINC000742183891	CC	On-Demand	Anodyne	PSMB5	15	43
CCCCCCCC(=O)N[C@](C)(CC)C(F)(F)F	ZINC000742223691	CI	On-Demand	Mild	CES2	55	47
CCCCCCCC(=O)N[C@](C)(CC)C(F)(F)F	ZINC000742223691	CI	On-Demand	Mild	CES1	60	47
CCCCCCCC(=O)N[C@](C)(CC)C(F)(F)F	ZINC000742223691	CI	On-Demand	Mild	EST1_PIG	82	47
CCCCCCCC(=O)N[C@](C)(CC)C(F)(F)F	ZINC000742223691	CI	On-Demand	Mild	CES2C	63	38
CCCCCCCC(=O)N[C@](C)(CC)C(F)(F)F	ZINC000742223691	CI	On-Demand	Mild	NOD1	48	37
CCCCCCCC(=O)N[C@](C)(CC)C(F)(F)F	ZINC000742223691	CI	On-Demand	Mild	CQSS	57	35
CCCCCCCC(=O)N[C@@](C)(CC)C(F)(F)F	ZINC000742223692	CI	On-Demand	Mild	CES2	55	47
CCCCCCCC(=O)N[C@@](C)(CC)C(F)(F)F	ZINC000742223692	CI	On-Demand	Mild	CES1	60	47
CCCCCCCC(=O)N[C@@](C)(CC)C(F)(F)F	ZINC000742223692	CI	On-Demand	Mild	EST1_PIG	82	47
CCCCCCCC(=O)N[C@@](C)(CC)C(F)(F)F	ZINC000742223692	CI	On-Demand	Mild	CES2C	63	38
CCCCCCCC(=O)N[C@@](C)(CC)C(F)(F)F	ZINC000742223692	CI	On-Demand	Mild	NOD1	48	37
CCCCCCCC(=O)N[C@@](C)(CC)C(F)(F)F	ZINC000742223692	CI	On-Demand	Mild	CQSS	57	35
CCCCCCCC(=O)N[C@H](C(C)(C)C)C(F)(F)F	ZINC000742224062	CI	On-Demand	Mild	CES2	54	46
CCCCCCCC(=O)N[C@H](C(C)(C)C)C(F)(F)F	ZINC000742224062	CI	On-Demand	Mild	CES1	53	46
CCCCCCCC(=O)N[C@H](C(C)(C)C)C(F)(F)F	ZINC000742224062	CI	On-Demand	Mild	EST1_PIG	76	46
CCCCCCCC(=O)N[C@H](C(C)(C)C)C(F)(F)F	ZINC000742224062	CI	On-Demand	Mild	CES2C	61	37
CCCCCCCC(=O)N[C@H](C(C)(C)C)C(F)(F)F	ZINC000742224062	CI	On-Demand	Mild	LPAR3	45	42
CCCCCCCC(=O)N[C@H](C(C)(C)C)C(F)(F)F	ZINC000742224062	CI	On-Demand	Mild	LASR	42	36
CCCCCCCC(=O)N[C@H](C(C)(C)C)C(F)(F)F	ZINC000742224062	CI	On-Demand	Mild	NOD1	94	46
CCCCCCCC(=O)N[C@H](C(C)(C)C)C(F)(F)F	ZINC000742224062	CI	On-Demand	Mild	CQSS	61	38
CCCCCCCC(=O)N[C@@H](C(C)(C)C)C(F)(F)F	ZINC000742224063	CI	On-Demand	Mild	CES2	54	46
CCCCCCCC(=O)N[C@@H](C(C)(C)C)C(F)(F)F	ZINC000742224063	CI	On-Demand	Mild	CES1	53	46
CCCCCCCC(=O)N[C@@H](C(C)(C)C)C(F)(F)F	ZINC000742224063	CI	On-Demand	Mild	EST1_PIG	76	46
CCCCCCCC(=O)N[C@@H](C(C)(C)C)C(F)(F)F	ZINC000742224063	CI	On-Demand	Mild	CES2C	61	37
CCCCCCCC(=O)N[C@@H](C(C)(C)C)C(F)(F)F	ZINC000742224063	CI	On-Demand	Mild	LPAR3	45	42
CCCCCCCC(=O)N[C@@H](C(C)(C)C)C(F)(F)F	ZINC000742224063	CI	On-Demand	Mild	LASR	42	36
CCCCCCCC(=O)N[C@@H](C(C)(C)C)C(F)(F)F	ZINC000742224063	CI	On-Demand	Mild	NOD1	94	46
CCCCCCCC(=O)N[C@@H](C(C)(C)C)C(F)(F)F	ZINC000742224063	CI	On-Demand	Mild	CQSS	61	38
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@H](C)C(=O)OC(C)C	ZINC000742236269	DD	On-Demand	Anodyne	CTSB	32	41
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@H](C)C(=O)OC(C)C	ZINC000742236269	DD	On-Demand	Anodyne	PAPA1_CARPA	42	38
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@H](C)C(=O)OC(C)C	ZINC000742236269	DD	On-Demand	Anodyne	CTSK	36	50
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@H](C)C(=O)OC(C)C	ZINC000742236269	DD	On-Demand	Anodyne	CTSL	31	45
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@H](C)C(=O)OC(C)C	ZINC000742236269	DD	On-Demand	Anodyne	CAPNS1	58	35
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@H](C)C(=O)OC(C)C	ZINC000742236269	DD	On-Demand	Anodyne	CTSS	22	50
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@H](C)C(=O)OC(C)C	ZINC000742236269	DD	On-Demand	Anodyne	CAPN1	82	51
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@H](C)C(=O)OC(C)C	ZINC000742236269	DD	On-Demand	Anodyne	CAPN2	109	39
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@H](C)C(=O)OC(C)C	ZINC000742236269	DD	On-Demand	Anodyne	FPR1	42	34
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@H](C)C(=O)OC(C)C	ZINC000742236269	DD	On-Demand	Anodyne	NPR	70	39
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@@H](C)C(=O)OC(C)C	ZINC000742236270	DD	On-Demand	Anodyne	CTSB	32	41
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@@H](C)C(=O)OC(C)C	ZINC000742236270	DD	On-Demand	Anodyne	PAPA1_CARPA	42	38
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@@H](C)C(=O)OC(C)C	ZINC000742236270	DD	On-Demand	Anodyne	CTSK	36	50
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@@H](C)C(=O)OC(C)C	ZINC000742236270	DD	On-Demand	Anodyne	CTSL	31	45
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@@H](C)C(=O)OC(C)C	ZINC000742236270	DD	On-Demand	Anodyne	CAPNS1	58	35
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@@H](C)C(=O)OC(C)C	ZINC000742236270	DD	On-Demand	Anodyne	CTSS	22	50
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@@H](C)C(=O)OC(C)C	ZINC000742236270	DD	On-Demand	Anodyne	CAPN1	82	51
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@@H](C)C(=O)OC(C)C	ZINC000742236270	DD	On-Demand	Anodyne	CAPN2	109	39
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@@H](C)C(=O)OC(C)C	ZINC000742236270	DD	On-Demand	Anodyne	FPR1	42	34
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@@H](C)C(=O)OC(C)C	ZINC000742236270	DD	On-Demand	Anodyne	NPR	70	39
C[C@@H](CCNS(=O)(=O)CCS(C)(=O)=O)NC(=O)OC(C)(C)C	ZINC000742286376	FC	On-Demand	Anodyne	CTSK	17	40
C[C@H](CCNS(=O)(=O)CCS(C)(=O)=O)NC(=O)OC(C)(C)C	ZINC000742286377	FC	On-Demand	Anodyne	CTSK	17	40
C[C@H](NC(=O)OC(C)(C)C)C(=O)NCCS(=O)(=O)NC(C)(C)C	ZINC000742287496	FC	On-Demand	Anodyne	CTSD	17	40
C[C@H](NC(=O)OC(C)(C)C)C(=O)NCCS(=O)(=O)NC(C)(C)C	ZINC000742287496	FC	On-Demand	Anodyne	CTSK	15	40
C[C@H](NC(=O)OC(C)(C)C)C(=O)NCCS(=O)(=O)NC(C)(C)C	ZINC000742287496	FC	On-Demand	Anodyne	PGA	15	41
CCCCS(=O)(=O)NCCOCCS(C)(=O)=O	ZINC000742310286	CB	On-Demand	Anodyne	RELA	17	40
CCCCCCCC(=O)N(CCC#N)CCC#N	ZINC000742360611	BG	On-Demand	Mild	CQSS	59	36
CCCCCCC(=O)N(CCC#N)CCC#N	ZINC000742360616	BF	On-Demand	Mild	CQSS	59	36
CCOC(=O)[C@H](C)NC(=O)CCCN(C)C(=O)OC(C)(C)C	ZINC000742361987	DD	On-Demand	Anodyne	NOD1	45	33
COC(=O)CSCCCCCCCO	ZINC000742448211	BD	On-Demand	Anodyne	EST1_PIG	45	38
CCCCC[C@@H](C)NC(=O)CS[C@H](C)C(C)C	ZINC000742460509	CH	On-Demand	Anodyne	NOD1	79	40
CCCCC[C@@H](C)NC(=O)CS[C@@H](C)C(C)C	ZINC000742460510	CH	On-Demand	Anodyne	NOD1	79	40
CCC(=O)N[C@H](C)C(=O)NCCNC(=O)OC(C)(C)C	ZINC000742461366	CC	On-Demand	Anodyne	CTSD	24	46
CCC(=O)N[C@H](C)C(=O)NCCNC(=O)OC(C)(C)C	ZINC000742461366	CC	On-Demand	Anodyne	PAPA1_CARPA	35	41
CCC(=O)N[C@H](C)C(=O)NCCNC(=O)OC(C)(C)C	ZINC000742461366	CC	On-Demand	Anodyne	CTSK	17	44
CCC(=O)N[C@H](C)C(=O)NCCNC(=O)OC(C)(C)C	ZINC000742461366	CC	On-Demand	Anodyne	PGA	50	46
CCC(=O)N[C@H](C)C(=O)NCCNC(=O)OC(C)(C)C	ZINC000742461366	CC	On-Demand	Anodyne	ECE1	33	41
CCC(=O)N[C@@H](C)C(=O)NCCNC(=O)OC(C)(C)C	ZINC000742461367	CC	On-Demand	Anodyne	CTSD	24	46
CCC(=O)N[C@@H](C)C(=O)NCCNC(=O)OC(C)(C)C	ZINC000742461367	CC	On-Demand	Anodyne	PAPA1_CARPA	35	41
CCC(=O)N[C@@H](C)C(=O)NCCNC(=O)OC(C)(C)C	ZINC000742461367	CC	On-Demand	Anodyne	CTSK	17	44
CCC(=O)N[C@@H](C)C(=O)NCCNC(=O)OC(C)(C)C	ZINC000742461367	CC	On-Demand	Anodyne	PGA	50	46
CCC(=O)N[C@@H](C)C(=O)NCCNC(=O)OC(C)(C)C	ZINC000742461367	CC	On-Demand	Anodyne	ECE1	33	41
CCCCCNC(=O)C[C@H](C)CCCCC	ZINC000742462262	BH	On-Demand	Anodyne	S1PR2	16	40
CCCCCNC(=O)C[C@H](C)CCCCC	ZINC000742462262	BH	On-Demand	Anodyne	ASAH1	75	35
CCCCCNC(=O)C[C@H](C)CCCCC	ZINC000742462262	BH	On-Demand	Anodyne	NOD1	62	45
CCCCCNC(=O)C[C@H](C)CCCCC	ZINC000742462262	BH	On-Demand	Anodyne	CQSS	51	33
CCCCCNC(=O)C[C@@H](C)CCCCC	ZINC000742462263	BH	On-Demand	Anodyne	S1PR2	16	40
CCCCCNC(=O)C[C@@H](C)CCCCC	ZINC000742462263	BH	On-Demand	Anodyne	ASAH1	75	35
CCCCCNC(=O)C[C@@H](C)CCCCC	ZINC000742462263	BH	On-Demand	Anodyne	NOD1	62	45
CCCCCNC(=O)C[C@@H](C)CCCCC	ZINC000742462263	BH	On-Demand	Anodyne	CQSS	51	33
CCCCC[C@@H](C)CC(=O)NC(C)C	ZINC000742462987	AG	On-Demand	Anodyne	NOD1	86	40
CCCCC[C@@H](C)CC(=O)NC(C)C	ZINC000742462987	AG	On-Demand	Anodyne	CQSS	58	38
CCCCCC[C@](C)(CC)C(=O)NC(C)C	ZINC000742463036	BH	On-Demand	Anodyne	CQSS	58	39
CCCCCNC(=O)/C=C(/C)C(C)(C)C	ZINC000742463048	BG	On-Demand	Anodyne	ASAH1	54	31
CCCCCC[C@](C)(CC)C(=O)N[C@H](C)CC	ZINC000742463241	BI	On-Demand	Anodyne	CQSS	53	33
CCCCCC[C@](C)(CC)C(=O)N[C@@H](C)CC	ZINC000742463247	BI	On-Demand	Anodyne	CQSS	53	33
CCCCCC[C@](C)(CCC)C(=O)NC(C)C	ZINC000742463933	BI	On-Demand	Anodyne	CES1	40	30
CCCCCC[C@](C)(CCC)C(=O)NC(C)C	ZINC000742463933	BI	On-Demand	Anodyne	CQSS	58	39
C=CCNC(=O)C[C@@H](C)NC(=O)OC(C)(C)C	ZINC000742465165	BD	On-Demand	Mild	CTSK	18	45
C=CCNC(=O)C[C@H](C)NC(=O)OC(C)(C)C	ZINC000742465166	BD	On-Demand	Mild	CTSK	18	45
CCCCC[C@@H](C)CC(=O)NCCC(C)C	ZINC000742465507	BH	On-Demand	Anodyne	NOD1	45	37
CCCCC[C@@H](C)CC(=O)N(CCC)CCC	ZINC000742466072	BI	On-Demand	Anodyne	CQSS	51	33
CCCCC[C@@H](C)CC(=O)NCCCC	ZINC000742466470	BH	On-Demand	Anodyne	NOD1	86	45
CCCCC[C@@H](C)CC(=O)NCCCC	ZINC000742466470	BH	On-Demand	Anodyne	CQSS	51	33
CCCCCC[C@](C)(CC)C(=O)NCCCC	ZINC000742466489	BI	On-Demand	Anodyne	ASAH1	58	33
CCCCC[C@@H](C)CC(=O)N(CC)CC	ZINC000742466730	BG	On-Demand	Anodyne	CQSS	58	38
C[C@H](CC(=O)NNC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C	ZINC000742467360	DD	On-Demand	Reactive	CTSK	19	47
C[C@@H](CC(=O)NNC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C	ZINC000742467361	DD	On-Demand	Reactive	CTSK	19	47
CCCCC[C@@H](C)CC(=O)NCCC	ZINC000742468067	AG	On-Demand	Anodyne	FDPS	15	43
CCCCC[C@@H](C)CC(=O)NCCC	ZINC000742468067	AG	On-Demand	Anodyne	NOD1	59	39
CCCCC[C@@H](C)CC(=O)NCCC	ZINC000742468067	AG	On-Demand	Anodyne	CQSS	51	33
CCCCCC[C@](C)(CCC)C(=O)NCCC	ZINC000742468487	BI	On-Demand	Anodyne	FDPS	20	43
CCCCCC[C@](C)(CCC)C(=O)NCCC	ZINC000742468487	BI	On-Demand	Anodyne	Q8WS26_TRYCR	31	43
CCCCC[C@@H](C)CC(=O)NC(CC)CC	ZINC000742469582	BH	On-Demand	Anodyne	NOD1	81	39
CCCCC[C@@H](C)CC(=O)NC(CC)CC	ZINC000742469582	BH	On-Demand	Anodyne	CQSS	54	33
CCCCCC[C@](C)(CC)C(=O)NCC(C)C	ZINC000742469737	BI	On-Demand	Anodyne	CQSS	50	33
CCOC(=O)NNC(=O)C[C@@H](C)NC(=O)OC(C)(C)C	ZINC000742469943	CD	On-Demand	Reactive	CTSD	16	41
CCOC(=O)NNC(=O)C[C@@H](C)NC(=O)OC(C)(C)C	ZINC000742469943	CD	On-Demand	Reactive	PAPA1_CARPA	33	52
CCOC(=O)NNC(=O)C[C@@H](C)NC(=O)OC(C)(C)C	ZINC000742469943	CD	On-Demand	Reactive	CTSK	18	52
CCOC(=O)NNC(=O)C[C@@H](C)NC(=O)OC(C)(C)C	ZINC000742469943	CD	On-Demand	Reactive	ECE1	27	41
CCOC(=O)NNC(=O)C[C@H](C)NC(=O)OC(C)(C)C	ZINC000742469945	CD	On-Demand	Reactive	CTSD	16	41
CCOC(=O)NNC(=O)C[C@H](C)NC(=O)OC(C)(C)C	ZINC000742469945	CD	On-Demand	Reactive	PAPA1_CARPA	33	52
CCOC(=O)NNC(=O)C[C@H](C)NC(=O)OC(C)(C)C	ZINC000742469945	CD	On-Demand	Reactive	CTSK	18	52
CCOC(=O)NNC(=O)C[C@H](C)NC(=O)OC(C)(C)C	ZINC000742469945	CD	On-Demand	Reactive	ECE1	27	41
CCCCC[C@@H](C)CC(=O)N[C@@H](C)COC	ZINC000742473236	BF	On-Demand	Anodyne	NOD1	71	36
CCCCC[C@@H](C)CC(=O)N[C@H](C)COC	ZINC000742473239	BF	On-Demand	Anodyne	NOD1	71	36
CCCCCC[C@](C)(CCC)C(N)=O	ZINC000742474712	AG	On-Demand	Anodyne	CES2	51	44
CCCCCC[C@](C)(CCC)C(N)=O	ZINC000742474712	AG	On-Demand	Anodyne	EST1_PIG	66	36
CCCCCC[C@](C)(CCC)C(N)=O	ZINC000742474712	AG	On-Demand	Anodyne	CES2C	60	44
CCCCCC[C@](C)(CCC)C(N)=O	ZINC000742474712	AG	On-Demand	Anodyne	CQSS	54	34
CCCCCC[C@](C)(CC)C(=O)NNC(=O)C(C)C	ZINC000742476703	CG	On-Demand	Reactive	CQSS	40	33
CCCCCC[C@](C)(CCC)C(=O)NNC(=O)C(C)C	ZINC000742477267	CH	On-Demand	Reactive	CQSS	40	33
CCCCC[C@@H](C)CC(=O)NCCNC(C)=O	ZINC000742481112	BD	On-Demand	Anodyne	NOD1	44	37
CCCCC[C@@H](C)CC(=O)NCCSC	ZINC000742482006	BG	On-Demand	Anodyne	NOD1	47	35
CNC(=O)CNC(=O)C[C@@H](C)NC(=O)OC(C)(C)C	ZINC000742486434	CC	On-Demand	Anodyne	CTSK	15	43
CNC(=O)CNC(=O)C[C@H](C)NC(=O)OC(C)(C)C	ZINC000742486435	CC	On-Demand	Anodyne	CTSK	15	43
CCCCC[C@@H](C)CC(=O)NCC(=O)NCC	ZINC000742487952	BD	On-Demand	Anodyne	NOD1	69	36
CCNC(=O)CNC(=O)C[C@@H](C)NC(=O)OC(C)(C)C	ZINC000742487964	CC	On-Demand	Anodyne	CTSK	17	43
CCNC(=O)CNC(=O)C[C@@H](C)NC(=O)OC(C)(C)C	ZINC000742487964	CC	On-Demand	Anodyne	ECE1	27	40
CCNC(=O)CNC(=O)C[C@H](C)NC(=O)OC(C)(C)C	ZINC000742487965	CC	On-Demand	Anodyne	CTSK	17	43
CCNC(=O)CNC(=O)C[C@H](C)NC(=O)OC(C)(C)C	ZINC000742487965	CC	On-Demand	Anodyne	ECE1	27	40
C[C@H](CC(=O)NCC(=O)N(C)C)NC(=O)OC(C)(C)C	ZINC000742490213	CC	On-Demand	Anodyne	CTSK	17	42
C[C@@H](CC(=O)NCC(=O)N(C)C)NC(=O)OC(C)(C)C	ZINC000742490214	CC	On-Demand	Anodyne	CTSK	17	42
C[C@@H](CC(=O)N(C)CC(=O)N(C)C)NC(=O)OC(C)(C)C	ZINC000742490661	DC	On-Demand	Anodyne	CTSK	18	43
C[C@@H](CC(=O)N(C)CC(=O)N(C)C)NC(=O)OC(C)(C)C	ZINC000742490661	DC	On-Demand	Anodyne	ECE1	16	41