CC[C@@H](NC(=O)CCC(C)(C)NC(=O)OC(C)(C)C)C(C)C	ZINC000737518328	DH	On-Demand	Anodyne	CTSK	15	44
CCC[C@@H](CC)NC(=O)CCC(C)(C)NC(=O)OC(C)(C)C	ZINC000737519490	DH	On-Demand	Anodyne	CTSK	15	43
CCC[C@H](CC)NC(=O)CCC(C)(C)NC(=O)OC(C)(C)C	ZINC000737519491	DH	On-Demand	Anodyne	CTSK	15	43
C=C(Cl)CSCCCCCC(=O)O	ZINC000737527034	BG	On-Demand	Mild	PLA2G4B	18	40
C=C(Cl)CSCCCCCC(=O)O	ZINC000737527034	BG	On-Demand	Mild	EST1_PIG	41	34
C=C(Cl)CSCCCCCC(=O)O	ZINC000737527034	BG	On-Demand	Mild	BHMT	40	47
C=CCCC(=O)N[C@H](C(=O)O)C(=O)OCC	ZINC000737527438	BC	On-Demand	Mild	NOD1	71	38
C=CCCC(=O)N[C@@H](C(=O)O)C(=O)OCC	ZINC000737527439	BC	On-Demand	Mild	NOD1	71	38
CNC(=O)[C@@H](C)NC(=O)[C@H](NC(=O)O)C(C)C	ZINC000737534279	BB	On-Demand	Anodyne	PGA	71	48
CNC(=O)[C@@H](C)NC(=O)[C@H](NC(=O)O)C(C)C	ZINC000737534279	BB	On-Demand	Anodyne	HLA-DRB1	54	35
CNC(=O)[C@@H](C)NC(=O)[C@H](NC(=O)O)C(C)C	ZINC000737534279	BB	On-Demand	Anodyne	CASP1	23	46
CNC(=O)[C@@H](C)NC(=O)[C@@H](NC(=O)O)C(C)C	ZINC000737534280	BB	On-Demand	Anodyne	PGA	71	48
CNC(=O)[C@@H](C)NC(=O)[C@@H](NC(=O)O)C(C)C	ZINC000737534280	BB	On-Demand	Anodyne	HLA-DRB1	54	35
CNC(=O)[C@@H](C)NC(=O)[C@@H](NC(=O)O)C(C)C	ZINC000737534280	BB	On-Demand	Anodyne	CASP1	23	46
CNC(=O)[C@@H](C)NC(=O)CCCNC(=O)O	ZINC000737534387	BB	On-Demand	Anodyne	SIRT1	17	45
CNC(=O)[C@@H](C)NC(=O)CCCNC(=O)O	ZINC000737534387	BB	On-Demand	Anodyne	WDR5	31	42
CNC(=O)[C@@H](C)NC(=O)CCCNC(=O)O	ZINC000737534387	BB	On-Demand	Anodyne	NOD1	48	35
CNC(=O)CCNC(=O)[C@H](NC(=O)O)C(C)C	ZINC000737536433	BB	On-Demand	Anodyne	PGA	75	36
CNC(=O)CCNC(=O)[C@@H](NC(=O)O)C(C)C	ZINC000737536435	BB	On-Demand	Anodyne	PGA	75	36
CNC(=O)CCCNC(=O)[C@@H](CC(C)C)NC(=O)O	ZINC000737536961	CC	On-Demand	Anodyne	CTSB	15	45
CNC(=O)CCCNC(=O)[C@@H](CC(C)C)NC(=O)O	ZINC000737536961	CC	On-Demand	Anodyne	CTSK	25	45
CNC(=O)CCCNC(=O)[C@@H](CC(C)C)NC(=O)O	ZINC000737536961	CC	On-Demand	Anodyne	CTSL	21	45
CNC(=O)CCCNC(=O)[C@@H](CC(C)C)NC(=O)O	ZINC000737536961	CC	On-Demand	Anodyne	PGA	46	38
CNC(=O)CCCNC(=O)[C@@H](CC(C)C)NC(=O)O	ZINC000737536961	CC	On-Demand	Anodyne	MMP8	20	41
CNC(=O)CCCNC(=O)[C@@H](CC(C)C)NC(=O)O	ZINC000737536961	CC	On-Demand	Anodyne	HLA-DRB1	40	36
CNC(=O)CCCNC(=O)[C@@H](CC(C)C)NC(=O)O	ZINC000737536961	CC	On-Demand	Anodyne	CTSS	15	45
CNC(=O)CCCNC(=O)[C@@H](CC(C)C)NC(=O)O	ZINC000737536961	CC	On-Demand	Anodyne	CAPN1	56	56
CNC(=O)CCCNC(=O)[C@@H](CC(C)C)NC(=O)O	ZINC000737536961	CC	On-Demand	Anodyne	CAPN2	55	49
CNC(=O)CCCNC(=O)[C@@H](CC(C)C)NC(=O)O	ZINC000737536961	CC	On-Demand	Anodyne	NPR	47	34
CNC(=O)CCCNC(=O)[C@@H](CC(C)C)NC(=O)O	ZINC000737536961	CC	On-Demand	Anodyne	Q9NAW4_PLAFA	26	45
CNC(=O)CCCNC(=O)[C@H](CC(C)C)NC(=O)O	ZINC000737536963	CC	On-Demand	Anodyne	CTSB	15	45
CNC(=O)CCCNC(=O)[C@H](CC(C)C)NC(=O)O	ZINC000737536963	CC	On-Demand	Anodyne	CTSK	25	45
CNC(=O)CCCNC(=O)[C@H](CC(C)C)NC(=O)O	ZINC000737536963	CC	On-Demand	Anodyne	CTSL	21	45
CNC(=O)CCCNC(=O)[C@H](CC(C)C)NC(=O)O	ZINC000737536963	CC	On-Demand	Anodyne	PGA	46	38
CNC(=O)CCCNC(=O)[C@H](CC(C)C)NC(=O)O	ZINC000737536963	CC	On-Demand	Anodyne	MMP8	20	41
CNC(=O)CCCNC(=O)[C@H](CC(C)C)NC(=O)O	ZINC000737536963	CC	On-Demand	Anodyne	HLA-DRB1	40	36
CNC(=O)CCCNC(=O)[C@H](CC(C)C)NC(=O)O	ZINC000737536963	CC	On-Demand	Anodyne	CTSS	15	45
CNC(=O)CCCNC(=O)[C@H](CC(C)C)NC(=O)O	ZINC000737536963	CC	On-Demand	Anodyne	CAPN1	56	56
CNC(=O)CCCNC(=O)[C@H](CC(C)C)NC(=O)O	ZINC000737536963	CC	On-Demand	Anodyne	CAPN2	55	49
CNC(=O)CCCNC(=O)[C@H](CC(C)C)NC(=O)O	ZINC000737536963	CC	On-Demand	Anodyne	NPR	47	34
CNC(=O)CCCNC(=O)[C@H](CC(C)C)NC(=O)O	ZINC000737536963	CC	On-Demand	Anodyne	Q9NAW4_PLAFA	26	45
CNC(=O)CCCNC(=O)[C@H](NC(=O)O)C(C)C	ZINC000737536997	CB	On-Demand	Anodyne	PGA	69	39
CNC(=O)CCCNC(=O)[C@@H](NC(=O)O)C(C)C	ZINC000737536999	CB	On-Demand	Anodyne	PGA	69	39
CNC(=O)CNC(=O)[C@H](NC(=O)O)C(C)C	ZINC000737540385	BB	On-Demand	Anodyne	PGA	71	37
CNC(=O)CNC(=O)[C@@H](NC(=O)O)C(C)C	ZINC000737540388	BB	On-Demand	Anodyne	PGA	71	37
CC(=O)N[C@@H](C(=O)OCCCC(=O)O)C(C)C	ZINC000737542326	BC	On-Demand	Anodyne	PAPA1_CARPA	21	44
CC(=O)N[C@@H](C(=O)OCCCC(=O)O)C(C)C	ZINC000737542326	BC	On-Demand	Anodyne	CASP6	31	42
CC(=O)N[C@@H](C(=O)OCCCC(=O)O)C(C)C	ZINC000737542326	BC	On-Demand	Anodyne	WDR5	41	40
CNC(=O)NNC(=O)[C@H](NC(=O)O)C(C)C	ZINC000737543259	BB	On-Demand	Reactive	PAPA1_CARPA	32	42
CNC(=O)NNC(=O)[C@@H](NC(=O)O)C(C)C	ZINC000737543260	BB	On-Demand	Reactive	PAPA1_CARPA	32	42
CNS(=O)(=O)CCCSCC(=O)O	ZINC000737553582	BB	On-Demand	Anodyne	EST1_PIG	40	35
COC(=O)[C@@H](CC(=O)O)NC(=O)[C@H](C)C(C)C	ZINC000737563822	BC	On-Demand	Anodyne	CASP3	34	45
COC(=O)[C@@H](CC(=O)O)NC(=O)[C@H](C)C(C)C	ZINC000737563822	BC	On-Demand	Anodyne	CASP1	19	40
COC(=O)[C@@H](CC(=O)O)NC(=O)[C@H](C)C(C)C	ZINC000737563822	BC	On-Demand	Anodyne	ENPEP	54	35
COC(=O)[C@@H](CC(=O)O)NC(=O)[C@@H](C)C(C)C	ZINC000737563823	BC	On-Demand	Anodyne	CASP3	34	45
COC(=O)[C@@H](CC(=O)O)NC(=O)[C@@H](C)C(C)C	ZINC000737563823	BC	On-Demand	Anodyne	CASP1	19	40
COC(=O)[C@@H](CC(=O)O)NC(=O)[C@@H](C)C(C)C	ZINC000737563823	BC	On-Demand	Anodyne	ENPEP	54	35
COC(=O)[C@@H](CC(=O)O)NC(=O)CCC(C)(C)C	ZINC000737565369	CC	On-Demand	Anodyne	NOD1	40	30
COC(=O)[C@@H](CC(=O)O)NC(=O)[C@@H](C)CSC	ZINC000737566093	CC	On-Demand	Anodyne	CASP3	25	40
COC(=O)[C@@H](CC(=O)O)NC(=O)[C@@H](C)CSC	ZINC000737566093	CC	On-Demand	Anodyne	ENPEP	52	34
COC(=O)[C@@H](CC(=O)O)NC(=O)[C@H](C)CSC	ZINC000737566094	CC	On-Demand	Anodyne	CASP3	25	40
COC(=O)[C@@H](CC(=O)O)NC(=O)[C@H](C)CSC	ZINC000737566094	CC	On-Demand	Anodyne	ENPEP	52	34
COC(=O)[C@@H](CC(=O)O)NC(=O)CNC(=O)OC(C)(C)C	ZINC000737566533	DB	On-Demand	Anodyne	PAPA1_CARPA	40	41
COC(=O)[C@@H](CC(=O)O)NC(=O)CNC(=O)OC(C)(C)C	ZINC000737566533	DB	On-Demand	Anodyne	CCKAR	30	42
COC(=O)[C@@H](CC(=O)O)NC(=O)[C@H](C)NC(C)=O	ZINC000737567531	CA	On-Demand	Anodyne	CASP3	24	41
COC(=O)[C@@H](CC(=O)O)NC(=O)[C@H](C)NC(C)=O	ZINC000737567531	CA	On-Demand	Anodyne	PGA	28	41
COC(=O)[C@@H](CC(=O)O)NC(=O)[C@H](C)NC(C)=O	ZINC000737567531	CA	On-Demand	Anodyne	CASP1	34	56
COC(=O)[C@@H](CC(=O)O)NC(=O)[C@H](C)NC(C)=O	ZINC000737567531	CA	On-Demand	Anodyne	ENPEP	52	34
COC(=O)[C@@H](CC(=O)O)NC(=O)[C@H](C)NC(C)=O	ZINC000737567531	CA	On-Demand	Anodyne	SIRT1	15	50
COC(=O)[C@@H](CC(=O)O)NC(=O)[C@H](C)NC(C)=O	ZINC000737567531	CA	On-Demand	Anodyne	WDR5	51	44
COC(=O)[C@@H](CC(=O)O)NC(=O)[C@@H](C)NC(C)=O	ZINC000737567534	CA	On-Demand	Anodyne	CASP3	24	41
COC(=O)[C@@H](CC(=O)O)NC(=O)[C@@H](C)NC(C)=O	ZINC000737567534	CA	On-Demand	Anodyne	PGA	28	41
COC(=O)[C@@H](CC(=O)O)NC(=O)[C@@H](C)NC(C)=O	ZINC000737567534	CA	On-Demand	Anodyne	CASP1	34	56
COC(=O)[C@@H](CC(=O)O)NC(=O)[C@@H](C)NC(C)=O	ZINC000737567534	CA	On-Demand	Anodyne	ENPEP	52	34
COC(=O)[C@@H](CC(=O)O)NC(=O)[C@@H](C)NC(C)=O	ZINC000737567534	CA	On-Demand	Anodyne	SIRT1	15	50
COC(=O)[C@@H](CC(=O)O)NC(=O)[C@@H](C)NC(C)=O	ZINC000737567534	CA	On-Demand	Anodyne	WDR5	51	44
COC(=O)[C@@H](CC(=O)O)NC(=O)CCCSC	ZINC000737567894	CC	On-Demand	Anodyne	NOD1	70	35
COC(=O)[C@@H](CNC(=O)O)CC(C)C	ZINC000737572652	BD	On-Demand	Anodyne	NPR	15	40
COC(=O)[C@H](CNC(=O)O)CC(C)C	ZINC000737572653	BD	On-Demand	Anodyne	NPR	15	40
COC(=O)[C@@H](CC(=O)O)NS(=O)(=O)CC(C)C	ZINC000737574131	CB	On-Demand	Anodyne	ENPEP	45	31
COC(=O)[C@@H](CNC(=O)[C@H](NC(=O)O)C(C)C)CC(C)C	ZINC000737574160	DD	On-Demand	Anodyne	PGA	83	40
COC(=O)[C@@H](CNC(=O)[C@H](NC(=O)O)C(C)C)CC(C)C	ZINC000737574160	DD	On-Demand	Anodyne	HLA-DRB1	44	32
COC(=O)[C@@H](CNC(=O)[C@H](NC(=O)O)C(C)C)CC(C)C	ZINC000737574160	DD	On-Demand	Anodyne	LAP3	15	40
COC(=O)[C@@H](CNC(=O)[C@H](NC(=O)O)C(C)C)CC(C)C	ZINC000737574160	DD	On-Demand	Anodyne	NPR	18	43
COC(=O)[C@@H](CNC(=O)[C@@H](NC(=O)O)C(C)C)CC(C)C	ZINC000737574162	DD	On-Demand	Anodyne	PGA	83	40
COC(=O)[C@@H](CNC(=O)[C@@H](NC(=O)O)C(C)C)CC(C)C	ZINC000737574162	DD	On-Demand	Anodyne	HLA-DRB1	44	32
COC(=O)[C@@H](CNC(=O)[C@@H](NC(=O)O)C(C)C)CC(C)C	ZINC000737574162	DD	On-Demand	Anodyne	LAP3	15	40
COC(=O)[C@@H](CNC(=O)[C@@H](NC(=O)O)C(C)C)CC(C)C	ZINC000737574162	DD	On-Demand	Anodyne	NPR	18	43
COC(=O)[C@H](CNC(=O)[C@@H](NC(=O)O)C(C)C)CC(C)C	ZINC000737574164	DD	On-Demand	Anodyne	PGA	83	40
COC(=O)[C@H](CNC(=O)[C@@H](NC(=O)O)C(C)C)CC(C)C	ZINC000737574164	DD	On-Demand	Anodyne	HLA-DRB1	44	32
COC(=O)[C@H](CNC(=O)[C@@H](NC(=O)O)C(C)C)CC(C)C	ZINC000737574164	DD	On-Demand	Anodyne	LAP3	15	40
COC(=O)[C@H](CNC(=O)[C@@H](NC(=O)O)C(C)C)CC(C)C	ZINC000737574164	DD	On-Demand	Anodyne	NPR	18	43
COC(=O)[C@H](CNC(=O)[C@H](NC(=O)O)C(C)C)CC(C)C	ZINC000737574166	DD	On-Demand	Anodyne	PGA	83	40
COC(=O)[C@H](CNC(=O)[C@H](NC(=O)O)C(C)C)CC(C)C	ZINC000737574166	DD	On-Demand	Anodyne	HLA-DRB1	44	32
COC(=O)[C@H](CNC(=O)[C@H](NC(=O)O)C(C)C)CC(C)C	ZINC000737574166	DD	On-Demand	Anodyne	LAP3	15	40
COC(=O)[C@H](CNC(=O)[C@H](NC(=O)O)C(C)C)CC(C)C	ZINC000737574166	DD	On-Demand	Anodyne	NPR	18	43
COC(=O)[C@@H](CC(C)C)NC(=O)CCNC(=O)O	ZINC000737574233	CC	On-Demand	Anodyne	CAPN2	53	32
COC(=O)[C@@H](CC(C)C)NC(=O)CCNC(=O)O	ZINC000737574233	CC	On-Demand	Anodyne	NPR	49	44
COC(=O)[C@@H](CC(C)C)NC(=O)CCNC(=O)O	ZINC000737574233	CC	On-Demand	Anodyne	NOD1	65	33
COC(=O)[C@H](NC(=O)CCCN(C)C(=O)O)C(C)C	ZINC000737575175	CC	On-Demand	Anodyne	NOD1	41	33
COC(=O)[C@@H](CC(=O)O)NS(=O)(=O)CCC(C)C	ZINC000737576625	CB	On-Demand	Anodyne	ENPEP	65	35
COC(=O)[C@@H](CC(C)C)NC(=O)CN(C)CC(=O)O	ZINC000737578176	CB	On-Demand	Anodyne	PGA	29	41
COC(=O)[C@@H](CC(C)C)NC(=O)CN(C)CC(=O)O	ZINC000737578176	CB	On-Demand	Anodyne	NPR	25	43
COC(=O)[C@H](NC(=O)CCCNC(=O)O)C(C)C	ZINC000737581136	CC	On-Demand	Anodyne	NOD1	66	36
CC(C)(CNC(=O)OC(C)(C)C)N/C=C(/C#N)C(=O)O	ZINC000737593376	CD	On-Demand	Reactive	PAPA1_CARPA	33	40
CC(C)(CNC(=O)OC(C)(C)C)N/C=C(\C#N)C(=O)O	ZINC000737593377	CD	On-Demand	Reactive	PAPA1_CARPA	33	40
COC(=O)CCCCNC(=O)[C@@H](NC(=O)O)C(C)C	ZINC000737595946	CC	On-Demand	Anodyne	PGA	49	36
COC(=O)CCCCNC(=O)[C@H](NC(=O)O)C(C)C	ZINC000737595949	CC	On-Demand	Anodyne	PGA	49	36
COC(=O)CCCCNC(=O)CCNC(=O)O	ZINC000737596293	BC	On-Demand	Anodyne	EPHX2	15	49
COC(=O)CN(CC(=O)O)C(=O)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000737602953	DB	On-Demand	Anodyne	CTSK	18	43
COC(=O)CN(CC(=O)O)C(=O)[C@H](C)NC(=O)OC(C)(C)C	ZINC000737602954	DB	On-Demand	Anodyne	CTSK	18	43
COC(=O)CN(CC(=O)O)C(=O)[C@H](C)CSC	ZINC000737602960	CC	On-Demand	Anodyne	ACE	20	49
COC(=O)CN(CC(=O)O)C(=O)[C@@H](C)CSC	ZINC000737602961	CC	On-Demand	Anodyne	ACE	20	49
COC(=O)CN(C)CC(=O)N[C@H](CC(C)C)C(=O)O	ZINC000737602992	CB	On-Demand	Anodyne	RIR1_HHV11	55	33
COC(=O)CN(C)CC(=O)N[C@H](CC(C)C)C(=O)O	ZINC000737602992	CB	On-Demand	Anodyne	NPR	30	41
COC(=O)CN(C)CC(=O)N[C@@H](CC(C)C)C(=O)O	ZINC000737602993	CB	On-Demand	Anodyne	RIR1_HHV11	55	33
COC(=O)CN(C)CC(=O)N[C@@H](CC(C)C)C(=O)O	ZINC000737602993	CB	On-Demand	Anodyne	NPR	30	41
COC(=O)CN(C)C(=O)COCC(=O)N(C)CC(=O)O	ZINC000737605712	CA	On-Demand	Anodyne	MVD	26	47
CC(C)[C@H](CN/C=C(/C#N)C(=O)O)NC(=O)OC(C)(C)C	ZINC000737612097	CD	On-Demand	Reactive	PAPA1_CARPA	37	42
CC(C)[C@H](CN/C=C(/C#N)C(=O)O)NC(=O)OC(C)(C)C	ZINC000737612097	CD	On-Demand	Reactive	CTSK	17	44
CC(C)[C@H](CN/C=C(\C#N)C(=O)O)NC(=O)OC(C)(C)C	ZINC000737612099	CD	On-Demand	Reactive	PAPA1_CARPA	37	42
CC(C)[C@H](CN/C=C(\C#N)C(=O)O)NC(=O)OC(C)(C)C	ZINC000737612099	CD	On-Demand	Reactive	CTSK	17	44
COC(=O)CN(CCS(C)(=O)=O)CC(=O)O	ZINC000737620418	CA	On-Demand	Anodyne	CA1	16	40
COC(=O)CN(CCS(C)(=O)=O)CC(=O)O	ZINC000737620418	CA	On-Demand	Anodyne	CA4	30	40
COC(=O)N[C@@H](C(=O)NS(=O)(=O)CCCC(=O)O)C(C)C	ZINC000737632870	DB	On-Demand	Anodyne	CASP3	16	49
COC(=O)N[C@H](C(=O)NS(=O)(=O)CCCC(=O)O)C(C)C	ZINC000737632872	DB	On-Demand	Anodyne	CASP3	16	49
COC(=O)N[C@@H](C(=O)NC[C@@H](CC(C)C)C(=O)O)C(C)C	ZINC000737633606	DD	On-Demand	Anodyne	PGA	89	37
COC(=O)N[C@@H](C(=O)NC[C@@H](CC(C)C)C(=O)O)C(C)C	ZINC000737633606	DD	On-Demand	Anodyne	LAP3	16	40
COC(=O)N[C@@H](C(=O)NC[C@H](CC(C)C)C(=O)O)C(C)C	ZINC000737633607	DD	On-Demand	Anodyne	PGA	89	37
COC(=O)N[C@@H](C(=O)NC[C@H](CC(C)C)C(=O)O)C(C)C	ZINC000737633607	DD	On-Demand	Anodyne	LAP3	16	40
COC(=O)N[C@@H](C(=O)NCCCC(=O)O)C(C)C	ZINC000737633613	CC	On-Demand	Anodyne	CASP3	18	51
COC(=O)N[C@@H](C(=O)NCCCC(=O)O)C(C)C	ZINC000737633613	CC	On-Demand	Anodyne	PGA	45	39
COC(=O)N[C@@H](C(=O)NCCCC(=O)O)C(C)C	ZINC000737633613	CC	On-Demand	Anodyne	PCSK5	50	34
COC(=O)N[C@@H](C(=O)NCCCC(=O)O)C(C)C	ZINC000737633613	CC	On-Demand	Anodyne	FURIN	47	34
COC(=O)N[C@@H](C(=O)NCCCC(=O)O)C(C)C	ZINC000737633613	CC	On-Demand	Anodyne	DLG4	48	33
COC(=O)N[C@@H](C(=O)NC[C@@H](C)C(=O)O)C(C)C	ZINC000737634284	CC	On-Demand	Anodyne	CASP3	15	52
COC(=O)N[C@@H](C(=O)NC[C@@H](C)C(=O)O)C(C)C	ZINC000737634284	CC	On-Demand	Anodyne	PGA	43	33
COC(=O)N[C@@H](C(=O)NC[C@H](C)C(=O)O)C(C)C	ZINC000737634285	CC	On-Demand	Anodyne	CASP3	15	52
COC(=O)N[C@@H](C(=O)NC[C@H](C)C(=O)O)C(C)C	ZINC000737634285	CC	On-Demand	Anodyne	PGA	43	33
COC(=O)N[C@H](C(=O)NC[C@@H](C)C(=O)O)C(C)C	ZINC000737634286	CC	On-Demand	Anodyne	CASP3	15	52
COC(=O)N[C@H](C(=O)NC[C@@H](C)C(=O)O)C(C)C	ZINC000737634286	CC	On-Demand	Anodyne	PGA	43	33
COC(=O)N[C@H](C(=O)NC[C@H](C)C(=O)O)C(C)C	ZINC000737634287	CC	On-Demand	Anodyne	CASP3	15	52
COC(=O)N[C@H](C(=O)NC[C@H](C)C(=O)O)C(C)C	ZINC000737634287	CC	On-Demand	Anodyne	PGA	43	33
COC(=O)N[C@@H](C(=O)NCCSCC(=O)O)C(C)C	ZINC000737634727	CC	On-Demand	Anodyne	CASP3	19	48
COC(=O)N[C@H](C(=O)NCCSCC(=O)O)C(C)C	ZINC000737634728	CC	On-Demand	Anodyne	CASP3	19	48
COC(=O)N[C@@H](C(=O)NCCCCC(=O)O)C(C)C	ZINC000737635123	CC	On-Demand	Anodyne	CASP3	18	50
COC(=O)N[C@@H](C(=O)NCCCCC(=O)O)C(C)C	ZINC000737635123	CC	On-Demand	Anodyne	PGA	42	33
COC(=O)N[C@@H](C(=O)NCCCCC(=O)O)C(C)C	ZINC000737635123	CC	On-Demand	Anodyne	PCSK5	51	36
COC(=O)N[C@@H](C(=O)NCCCCC(=O)O)C(C)C	ZINC000737635123	CC	On-Demand	Anodyne	FURIN	47	36
COC(=O)N[C@@H](C(=O)NCCCCC(=O)O)C(C)C	ZINC000737635123	CC	On-Demand	Anodyne	DLG4	40	33
COC(=O)N[C@H](CC(C)C)C(=O)OCCNC(=O)O	ZINC000737638396	CC	On-Demand	Anodyne	CTSK	21	45
COC(=O)N[C@H](CC(C)C)C(=O)OCCNC(=O)O	ZINC000737638396	CC	On-Demand	Anodyne	CAPNS1	55	34
COC(=O)N[C@H](CC(C)C)C(=O)OCCNC(=O)O	ZINC000737638396	CC	On-Demand	Anodyne	CAPN1	64	45
COC(=O)N[C@H](CC(C)C)C(=O)OCCNC(=O)O	ZINC000737638396	CC	On-Demand	Anodyne	CAPN2	93	36
COC(=O)N[C@H](CC(C)C)C(=O)OCCNC(=O)O	ZINC000737638396	CC	On-Demand	Anodyne	NPR	58	38
COC(=O)N[C@@H](CC(C)C)C(=O)OCCNC(=O)O	ZINC000737638399	CC	On-Demand	Anodyne	CTSK	21	45
COC(=O)N[C@@H](CC(C)C)C(=O)OCCNC(=O)O	ZINC000737638399	CC	On-Demand	Anodyne	CAPNS1	55	34
COC(=O)N[C@@H](CC(C)C)C(=O)OCCNC(=O)O	ZINC000737638399	CC	On-Demand	Anodyne	CAPN1	64	45
COC(=O)N[C@@H](CC(C)C)C(=O)OCCNC(=O)O	ZINC000737638399	CC	On-Demand	Anodyne	CAPN2	93	36
COC(=O)N[C@@H](CC(C)C)C(=O)OCCNC(=O)O	ZINC000737638399	CC	On-Demand	Anodyne	NPR	58	38
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@@H](C)C(=O)O	ZINC000737638735	CC	On-Demand	Anodyne	KLK3	59	35
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@@H](C)C(=O)O	ZINC000737638735	CC	On-Demand	Anodyne	CTSB	43	41
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@@H](C)C(=O)O	ZINC000737638735	CC	On-Demand	Anodyne	PAPA1_CARPA	54	38
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@@H](C)C(=O)O	ZINC000737638735	CC	On-Demand	Anodyne	CTSK	46	57
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@@H](C)C(=O)O	ZINC000737638735	CC	On-Demand	Anodyne	CTSL	41	48
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@@H](C)C(=O)O	ZINC000737638735	CC	On-Demand	Anodyne	HLA-A	41	37
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@@H](C)C(=O)O	ZINC000737638735	CC	On-Demand	Anodyne	CAPNS1	61	38
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@@H](C)C(=O)O	ZINC000737638735	CC	On-Demand	Anodyne	CTSS	30	57
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@@H](C)C(=O)O	ZINC000737638735	CC	On-Demand	Anodyne	CAPN1	100	55
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@@H](C)C(=O)O	ZINC000737638735	CC	On-Demand	Anodyne	CAPN2	129	42
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@@H](C)C(=O)O	ZINC000737638735	CC	On-Demand	Anodyne	LAP3	23	44
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@@H](C)C(=O)O	ZINC000737638735	CC	On-Demand	Anodyne	FPR1	77	41
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@@H](C)C(=O)O	ZINC000737638735	CC	On-Demand	Anodyne	NPR	83	41
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@H](C)C(=O)O	ZINC000737638737	CC	On-Demand	Anodyne	KLK3	59	35
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@H](C)C(=O)O	ZINC000737638737	CC	On-Demand	Anodyne	CTSB	43	41
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@H](C)C(=O)O	ZINC000737638737	CC	On-Demand	Anodyne	PAPA1_CARPA	54	38
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@H](C)C(=O)O	ZINC000737638737	CC	On-Demand	Anodyne	CTSK	46	57
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@H](C)C(=O)O	ZINC000737638737	CC	On-Demand	Anodyne	CTSL	41	48
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@H](C)C(=O)O	ZINC000737638737	CC	On-Demand	Anodyne	HLA-A	41	37
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@H](C)C(=O)O	ZINC000737638737	CC	On-Demand	Anodyne	CAPNS1	61	38
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@H](C)C(=O)O	ZINC000737638737	CC	On-Demand	Anodyne	CTSS	30	57
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@H](C)C(=O)O	ZINC000737638737	CC	On-Demand	Anodyne	CAPN1	100	55
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@H](C)C(=O)O	ZINC000737638737	CC	On-Demand	Anodyne	CAPN2	129	42
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@H](C)C(=O)O	ZINC000737638737	CC	On-Demand	Anodyne	LAP3	23	44
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@H](C)C(=O)O	ZINC000737638737	CC	On-Demand	Anodyne	FPR1	77	41
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@H](C)C(=O)O	ZINC000737638737	CC	On-Demand	Anodyne	NPR	83	41
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@H](C)C(=O)O	ZINC000737638738	CC	On-Demand	Anodyne	KLK3	59	35
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@H](C)C(=O)O	ZINC000737638738	CC	On-Demand	Anodyne	CTSB	43	41
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@H](C)C(=O)O	ZINC000737638738	CC	On-Demand	Anodyne	PAPA1_CARPA	54	38
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@H](C)C(=O)O	ZINC000737638738	CC	On-Demand	Anodyne	CTSK	46	57
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@H](C)C(=O)O	ZINC000737638738	CC	On-Demand	Anodyne	CTSL	41	48
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@H](C)C(=O)O	ZINC000737638738	CC	On-Demand	Anodyne	HLA-A	41	37
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@H](C)C(=O)O	ZINC000737638738	CC	On-Demand	Anodyne	CAPNS1	61	38
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@H](C)C(=O)O	ZINC000737638738	CC	On-Demand	Anodyne	CTSS	30	57
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@H](C)C(=O)O	ZINC000737638738	CC	On-Demand	Anodyne	CAPN1	100	55
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@H](C)C(=O)O	ZINC000737638738	CC	On-Demand	Anodyne	CAPN2	129	42
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@H](C)C(=O)O	ZINC000737638738	CC	On-Demand	Anodyne	LAP3	23	44
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@H](C)C(=O)O	ZINC000737638738	CC	On-Demand	Anodyne	FPR1	77	41
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@H](C)C(=O)O	ZINC000737638738	CC	On-Demand	Anodyne	NPR	83	41
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@@H](C)C(=O)O	ZINC000737638740	CC	On-Demand	Anodyne	KLK3	59	35
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@@H](C)C(=O)O	ZINC000737638740	CC	On-Demand	Anodyne	CTSB	43	41
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@@H](C)C(=O)O	ZINC000737638740	CC	On-Demand	Anodyne	PAPA1_CARPA	54	38
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@@H](C)C(=O)O	ZINC000737638740	CC	On-Demand	Anodyne	CTSK	46	57
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@@H](C)C(=O)O	ZINC000737638740	CC	On-Demand	Anodyne	CTSL	41	48
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@@H](C)C(=O)O	ZINC000737638740	CC	On-Demand	Anodyne	HLA-A	41	37
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@@H](C)C(=O)O	ZINC000737638740	CC	On-Demand	Anodyne	CAPNS1	61	38
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@@H](C)C(=O)O	ZINC000737638740	CC	On-Demand	Anodyne	CTSS	30	57
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@@H](C)C(=O)O	ZINC000737638740	CC	On-Demand	Anodyne	CAPN1	100	55
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@@H](C)C(=O)O	ZINC000737638740	CC	On-Demand	Anodyne	CAPN2	129	42
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@@H](C)C(=O)O	ZINC000737638740	CC	On-Demand	Anodyne	LAP3	23	44
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@@H](C)C(=O)O	ZINC000737638740	CC	On-Demand	Anodyne	FPR1	77	41
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@@H](C)C(=O)O	ZINC000737638740	CC	On-Demand	Anodyne	NPR	83	41
C[C@@H](CCNC(=O)CC(=O)O)NC(=O)OC(C)(C)C	ZINC000737666693	CC	On-Demand	Anodyne	PAPA1_CARPA	36	43
C[C@@H](CCNC(=O)CC(=O)O)NC(=O)OC(C)(C)C	ZINC000737666693	CC	On-Demand	Anodyne	CTSK	20	47
C[C@@H](CCNC(=O)CC(=O)O)NC(=O)OC(C)(C)C	ZINC000737666693	CC	On-Demand	Anodyne	ECE1	20	42
C[C@@H](CNC(=O)OC(C)(C)C)N(C)C(=O)CC(=O)O	ZINC000737669801	CC	On-Demand	Anodyne	CTSK	15	43
C[C@@H](NC(=O)CCCCN(C)C)C(=O)O	ZINC000737675250	BC	On-Demand	Anodyne	NOD1	66	41
CCCCSCC(=O)N[C@@H](CC)COC	ZINC000737709872	BE	On-Demand	Anodyne	CES1	16	40
CCCCSCC(=O)N[C@@H](CC)COC	ZINC000737709872	BE	On-Demand	Anodyne	EST1_PIG	46	40
CCCCSCC(=O)N[C@H](CC)COC	ZINC000737709874	BE	On-Demand	Anodyne	CES1	16	40
CCCCSCC(=O)N[C@H](CC)COC	ZINC000737709874	BE	On-Demand	Anodyne	EST1_PIG	46	40
CCCCCCCC(=O)N[C@H](CC)COC	ZINC000737711697	BF	On-Demand	Mild	LPAR1	42	38
CCCCCCCC(=O)N[C@H](CC)COC	ZINC000737711697	BF	On-Demand	Mild	LPAR3	80	45
CCCCCCCC(=O)N[C@H](CC)COC	ZINC000737711697	BF	On-Demand	Mild	NOD1	99	46
CCCCCCCC(=O)N[C@H](CC)COC	ZINC000737711697	BF	On-Demand	Mild	CQSS	65	41
CCCCCCCC(=O)N[C@@H](CC)COC	ZINC000737711699	BF	On-Demand	Mild	LPAR1	42	38
CCCCCCCC(=O)N[C@@H](CC)COC	ZINC000737711699	BF	On-Demand	Mild	LPAR3	80	45
CCCCCCCC(=O)N[C@@H](CC)COC	ZINC000737711699	BF	On-Demand	Mild	NOD1	99	46
CCCCCCCC(=O)N[C@@H](CC)COC	ZINC000737711699	BF	On-Demand	Mild	CQSS	65	41
C[C@H](SCCCCCC(=O)O)C(=O)N(C)C	ZINC000737717665	BD	On-Demand	Anodyne	FABP5	15	44
CO[C@@H](C)CCNC(=O)[C@@H](NC(=O)O)C(C)C	ZINC000737732207	BC	On-Demand	Anodyne	PGA	49	35
CO[C@@H](C)CCNC(=O)[C@H](NC(=O)O)C(C)C	ZINC000737736635	BC	On-Demand	Anodyne	PGA	49	35
COC(C)(C)C(=O)OCC(=O)N[C@H](CC(C)C)C(=O)O	ZINC000737736832	CC	On-Demand	Anodyne	PGA	21	44
COC(C)(C)C(=O)OCC(=O)N[C@H](CC(C)C)C(=O)O	ZINC000737736832	CC	On-Demand	Anodyne	LAP3	17	43
COC(C)(C)C(=O)OCC(=O)N[C@H](CC(C)C)C(=O)O	ZINC000737736832	CC	On-Demand	Anodyne	FPR1	44	33
COC(C)(C)C(=O)OCC(=O)N[C@H](CC(C)C)C(=O)O	ZINC000737736832	CC	On-Demand	Anodyne	NOD1	48	30
COC(C)(C)C(=O)OCC(=O)N[C@@H](CC(C)C)C(=O)O	ZINC000737736833	CC	On-Demand	Anodyne	PGA	21	44
COC(C)(C)C(=O)OCC(=O)N[C@@H](CC(C)C)C(=O)O	ZINC000737736833	CC	On-Demand	Anodyne	LAP3	17	43
COC(C)(C)C(=O)OCC(=O)N[C@@H](CC(C)C)C(=O)O	ZINC000737736833	CC	On-Demand	Anodyne	FPR1	44	33
COC(C)(C)C(=O)OCC(=O)N[C@@H](CC(C)C)C(=O)O	ZINC000737736833	CC	On-Demand	Anodyne	NOD1	48	30
COC[C@@H](C)S(=O)(=O)NC(=O)[C@H](CC(C)C)NC(=O)O	ZINC000737744805	DC	On-Demand	Anodyne	CAPN1	48	40
COC[C@@H](C)S(=O)(=O)NC(=O)[C@H](CC(C)C)NC(=O)O	ZINC000737744805	DC	On-Demand	Anodyne	NPR	40	33
COC[C@@H](C)S(=O)(=O)NC(=O)[C@@H](CC(C)C)NC(=O)O	ZINC000737744811	DC	On-Demand	Anodyne	CAPN1	48	40
COC[C@@H](C)S(=O)(=O)NC(=O)[C@@H](CC(C)C)NC(=O)O	ZINC000737744811	DC	On-Demand	Anodyne	NPR	40	33
COC[C@@H](C)S(=O)(=O)N[C@H](CC(=O)O)C(=O)OC	ZINC000737747522	CA	On-Demand	Anodyne	ENPEP	51	32
COC[C@@H](C)S(=O)(=O)N[C@@H](CC(=O)O)C(=O)OC	ZINC000737747524	CA	On-Demand	Anodyne	ENPEP	51	32
COC[C@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)OC	ZINC000737747747	BB	On-Demand	Anodyne	CASP3	24	42
COC[C@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)OC	ZINC000737747747	BB	On-Demand	Anodyne	ENPEP	54	35
COC[C@H](C)C(=O)N[C@H](CC(=O)O)C(=O)OC	ZINC000737747750	BB	On-Demand	Anodyne	CASP3	24	42
COC[C@H](C)C(=O)N[C@H](CC(=O)O)C(=O)OC	ZINC000737747750	BB	On-Demand	Anodyne	ENPEP	54	35
COC[C@@H](C)C(=O)N[C@H](CC(=O)O)C(=O)OC	ZINC000737747754	BB	On-Demand	Anodyne	CASP3	24	42
COC[C@@H](C)C(=O)N[C@H](CC(=O)O)C(=O)OC	ZINC000737747754	BB	On-Demand	Anodyne	ENPEP	54	35
COC[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)OC	ZINC000737747756	BB	On-Demand	Anodyne	CASP3	24	42
COC[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)OC	ZINC000737747756	BB	On-Demand	Anodyne	ENPEP	54	35
COC[C@@H](NC(=O)CCCNC(=O)O)C(C)C	ZINC000737747902	BC	On-Demand	Anodyne	NOD1	46	33
COC[C@H](NC(=O)CCCNC(=O)O)C(C)C	ZINC000737747907	BC	On-Demand	Anodyne	NOD1	46	33
COC[C@@H](C)C(=O)N(CC(=O)O)CC(=O)OC	ZINC000737748277	BB	On-Demand	Anodyne	ACE	15	53
COC[C@H](C)C(=O)N(CC(=O)O)CC(=O)OC	ZINC000737748281	BB	On-Demand	Anodyne	ACE	15	53
COC[C@@H](C)NC(=O)CCCNC(=O)O	ZINC000737748369	BC	On-Demand	Anodyne	NOD1	64	34
COC[C@H](C)NC(=O)CCCNC(=O)O	ZINC000737748370	BC	On-Demand	Anodyne	NOD1	64	34
COC[C@@H](C)OC(=O)CCSCC(=O)O	ZINC000737748626	BC	On-Demand	Anodyne	BHMT	43	40
COC[C@H](C)OC(=O)CCSCC(=O)O	ZINC000737748630	BC	On-Demand	Anodyne	BHMT	43	40
COC[C@H](C)C(=O)N[C@@H](CC(=O)OC)C(=O)O	ZINC000737749875	BB	On-Demand	Anodyne	MME	23	40
COC[C@H](C)C(=O)N[C@@H](CC(=O)OC)C(=O)O	ZINC000737749875	BB	On-Demand	Anodyne	ENPEP	49	35
COC[C@H](C)C(=O)N[C@@H](CC(=O)OC)C(=O)O	ZINC000737749875	BB	On-Demand	Anodyne	ACE2	44	33
COC[C@H](C)C(=O)N[C@H](CC(=O)OC)C(=O)O	ZINC000737749877	BB	On-Demand	Anodyne	MME	23	40
COC[C@H](C)C(=O)N[C@H](CC(=O)OC)C(=O)O	ZINC000737749877	BB	On-Demand	Anodyne	ENPEP	49	35
COC[C@H](C)C(=O)N[C@H](CC(=O)OC)C(=O)O	ZINC000737749877	BB	On-Demand	Anodyne	ACE2	44	33
COC[C@@H](C)C(=O)N[C@H](CC(=O)OC)C(=O)O	ZINC000737749879	BB	On-Demand	Anodyne	MME	23	40
COC[C@@H](C)C(=O)N[C@H](CC(=O)OC)C(=O)O	ZINC000737749879	BB	On-Demand	Anodyne	ENPEP	49	35
COC[C@@H](C)C(=O)N[C@H](CC(=O)OC)C(=O)O	ZINC000737749879	BB	On-Demand	Anodyne	ACE2	44	33
COC[C@@H](C)C(=O)N[C@@H](CC(=O)OC)C(=O)O	ZINC000737749882	BB	On-Demand	Anodyne	MME	23	40
COC[C@@H](C)C(=O)N[C@@H](CC(=O)OC)C(=O)O	ZINC000737749882	BB	On-Demand	Anodyne	ENPEP	49	35
COC[C@@H](C)C(=O)N[C@@H](CC(=O)OC)C(=O)O	ZINC000737749882	BB	On-Demand	Anodyne	ACE2	44	33
COCC[C@@H](C)NC(=O)[C@@H](NC(=O)O)C(C)C	ZINC000737753673	BC	On-Demand	Anodyne	PGA	61	34
COCC[C@H](C)NC(=O)[C@H](NC(=O)O)C(C)C	ZINC000737753674	BC	On-Demand	Anodyne	PGA	61	34
COCC[C@H](C)NC(=O)[C@@H](NC(=O)O)C(C)C	ZINC000737753676	BC	On-Demand	Anodyne	PGA	61	34
COCC[C@@H](C)NC(=O)[C@H](NC(=O)O)C(C)C	ZINC000737753677	BC	On-Demand	Anodyne	PGA	61	34
COCC[C@@H](C)NC(=O)CCCNC(=O)O	ZINC000737753735	BC	On-Demand	Anodyne	NOD1	76	36
COCC[C@H](C)NC(=O)CCCNC(=O)O	ZINC000737753736	BC	On-Demand	Anodyne	NOD1	76	36
COCC[C@@H](C)NC(=O)CCCN(C)C(=O)O	ZINC000737753777	BC	On-Demand	Anodyne	NOD1	54	33
COCC[C@H](C)NC(=O)CCCN(C)C(=O)O	ZINC000737753779	BC	On-Demand	Anodyne	NOD1	54	33
COCC[C@@H](C)NC(=O)CCSCC(=O)O	ZINC000737754923	BC	On-Demand	Anodyne	NOD1	46	33
COCC[C@H](C)NC(=O)CCSCC(=O)O	ZINC000737754925	BC	On-Demand	Anodyne	NOD1	46	33
COCCCN(C)CCC(=O)N(C)CC(=O)O	ZINC000737759769	BB	On-Demand	Anodyne	MVD	26	40
COCCCCCSCC(=O)O	ZINC000737760393	AD	On-Demand	Anodyne	PLA2G4B	20	40
COCCCCCSCC(=O)O	ZINC000737760393	AD	On-Demand	Anodyne	EST1_PIG	45	38
COCCCOC(=O)[C@@H](CC(C)C)NC(=O)O	ZINC000737763387	BD	On-Demand	Anodyne	NPR	41	39
COCCCOC(=O)[C@H](CC(C)C)NC(=O)O	ZINC000737763389	BD	On-Demand	Anodyne	NPR	41	39
COCCCNC(=O)NNC(=O)[C@H](NC(=O)O)C(C)C	ZINC000737763455	CB	On-Demand	Reactive	PAPA1_CARPA	42	38
COCCCNC(=O)NNC(=O)[C@@H](NC(=O)O)C(C)C	ZINC000737763457	CB	On-Demand	Reactive	PAPA1_CARPA	42	38
COCCN(CC(=O)O)C(=O)[C@H](C)NC(=O)OC(C)(C)C	ZINC000737768079	DC	On-Demand	Anodyne	CTSK	17	47
C/C=C/C(=O)N[C@@](C)(CCCCCC)C(=O)O	ZINC000737771077	BE	On-Demand	Anodyne	CES1	40	29
C/C=C/C(=O)N[C@@](C)(CCCCCC)C(=O)O	ZINC000737771077	BE	On-Demand	Anodyne	EST1_PIG	49	29
C/C=C/C(=O)N[C@](C)(CCCCCC)C(=O)O	ZINC000737771078	BE	On-Demand	Anodyne	CES1	40	29
C/C=C/C(=O)N[C@](C)(CCCCCC)C(=O)O	ZINC000737771078	BE	On-Demand	Anodyne	EST1_PIG	49	29
C/C=C\C(=O)N[C@@](C)(CCCCCC)C(=O)O	ZINC000737771083	BE	On-Demand	Anodyne	CES1	40	29
C/C=C\C(=O)N[C@@](C)(CCCCCC)C(=O)O	ZINC000737771083	BE	On-Demand	Anodyne	EST1_PIG	49	29
C/C=C\C(=O)N[C@](C)(CCCCCC)C(=O)O	ZINC000737771087	BE	On-Demand	Anodyne	CES1	40	29
C/C=C\C(=O)N[C@](C)(CCCCCC)C(=O)O	ZINC000737771087	BE	On-Demand	Anodyne	EST1_PIG	49	29
CCC(=O)N[C@H](C)C(=O)OCCCC(=O)O	ZINC000737771717	BC	On-Demand	Anodyne	NOD1	48	37
CCC(=O)N[C@@H](C)C(=O)OCCCC(=O)O	ZINC000737771721	BC	On-Demand	Anodyne	NOD1	48	37
CCC(=O)N[C@@H](C)C(=O)OCCC(=O)O	ZINC000737772580	BB	On-Demand	Anodyne	NOD1	41	33
CCC(=O)N[C@H](C)C(=O)OCCC(=O)O	ZINC000737772583	BB	On-Demand	Anodyne	NOD1	41	33
C/C=C\CSCCCCCC(=O)O	ZINC000737774400	BF	On-Demand	Anodyne	FABP3	37	44
C/C=C\CSCCCCCC(=O)O	ZINC000737774400	BF	On-Demand	Anodyne	FABP5	16	44
C/C=C\CSCCCCCC(=O)O	ZINC000737774400	BF	On-Demand	Anodyne	BHMT	30	46
C/C=C/CSCCCCCC(=O)O	ZINC000737774401	BF	On-Demand	Anodyne	FABP3	37	44
C/C=C/CSCCCCCC(=O)O	ZINC000737774401	BF	On-Demand	Anodyne	FABP5	16	44
C/C=C/CSCCCCCC(=O)O	ZINC000737774401	BF	On-Demand	Anodyne	BHMT	30	46
CC[C@@H](C)C(=O)O[C@H](C)C(=O)O	ZINC000737776540	AD	On-Demand	Anodyne	ENPEP	51	31
CC[C@@H](C)C(=O)O[C@@H](C)C(=O)O	ZINC000737776543	AD	On-Demand	Anodyne	ENPEP	51	31
CC[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)O	ZINC000737777955	CD	On-Demand	Reactive	CTSD	23	53
CC[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)O	ZINC000737777955	CD	On-Demand	Reactive	PAPA1_CARPA	48	50
CC[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)O	ZINC000737777955	CD	On-Demand	Reactive	CTSK	23	51
CC[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)O	ZINC000737777955	CD	On-Demand	Reactive	ECE1	46	53
CC[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)O	ZINC000737777955	CD	On-Demand	Reactive	ENPEP	56	32
CC[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)O	ZINC000737777955	CD	On-Demand	Reactive	PGA5	30	45
CC[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)O	ZINC000737777955	CD	On-Demand	Reactive	POLG_HCV1	29	52
CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)O	ZINC000737777959	CD	On-Demand	Reactive	CTSD	23	53
CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)O	ZINC000737777959	CD	On-Demand	Reactive	PAPA1_CARPA	48	50
CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)O	ZINC000737777959	CD	On-Demand	Reactive	CTSK	23	51
CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)O	ZINC000737777959	CD	On-Demand	Reactive	ECE1	46	53
CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)O	ZINC000737777959	CD	On-Demand	Reactive	ENPEP	56	32
CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)O	ZINC000737777959	CD	On-Demand	Reactive	PGA5	30	45
CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)O	ZINC000737777959	CD	On-Demand	Reactive	POLG_HCV1	29	52
CCC(CC)SCCCCC(=O)O	ZINC000737785657	BG	On-Demand	Anodyne	FABP3	34	42
CCC(CC)SCCCCC(=O)O	ZINC000737785657	BG	On-Demand	Anodyne	FABP5	17	52
CCC(CC)SCCCCC(=O)O	ZINC000737785657	BG	On-Demand	Anodyne	BHMT	30	46
CCC(CC)SCCCCC(=O)O	ZINC000737785657	BG	On-Demand	Anodyne	CQSS	56	35
CCC(CC)C(=O)OCCN(C)C(=O)O	ZINC000737791530	BD	On-Demand	Anodyne	CHRNA4	17	40
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)O	ZINC000737799915	CC	On-Demand	Reactive	CTSD	16	40
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)O	ZINC000737799915	CC	On-Demand	Reactive	PAPA1_CARPA	44	66
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)O	ZINC000737799915	CC	On-Demand	Reactive	CTSK	31	51
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)O	ZINC000737799915	CC	On-Demand	Reactive	ECE1	30	42
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)O	ZINC000737799915	CC	On-Demand	Reactive	PGA5	25	45
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)O	ZINC000737799915	CC	On-Demand	Reactive	POLG_HCV1	24	44
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)O	ZINC000737799915	CC	On-Demand	Reactive	FPR1	45	38
CCCCCCCCC/C=C\C(=O)NNC(=O)NC	ZINC000737804964	CF	On-Demand	Reactive	FABP3	34	43
CCCCCCCCC/C=C/C(=O)NNC(=O)NC	ZINC000737804967	CF	On-Demand	Reactive	FABP3	34	43
CCCC[C@H](COC)N[C@@H](C)C(=O)O	ZINC000737808845	BD	On-Demand	Anodyne	NOD1	45	33
CCCC[C@@H](COC)N[C@@H](C)C(=O)O	ZINC000737808849	BD	On-Demand	Anodyne	NOD1	45	33
CCCCCCC(=O)O[C@H](C)C(=O)O	ZINC000737809205	BD	On-Demand	Anodyne	PLA2G4B	52	34
CCCCCCC(=O)O[C@H](C)C(=O)O	ZINC000737809205	BD	On-Demand	Anodyne	PRKCA	22	51
CCCCCCC(=O)O[C@H](C)C(=O)O	ZINC000737809205	BD	On-Demand	Anodyne	LPAR3	44	45
CCCCCCC(=O)O[C@H](C)C(=O)O	ZINC000737809205	BD	On-Demand	Anodyne	FABP3	34	40
CCCCCCC(=O)O[C@H](C)C(=O)O	ZINC000737809205	BD	On-Demand	Anodyne	FABP5	16	48
CCCCCCC(=O)O[C@H](C)C(=O)O	ZINC000737809205	BD	On-Demand	Anodyne	ENPP2	20	40
CCCCCCC(=O)O[C@H](C)C(=O)O	ZINC000737809205	BD	On-Demand	Anodyne	NOD1	87	44
CCCCCCC(=O)O[C@H](C)C(=O)O	ZINC000737809205	BD	On-Demand	Anodyne	CQSS	70	47
CCCCCCC(=O)O[C@@H](C)C(=O)O	ZINC000737809208	BD	On-Demand	Anodyne	PLA2G4B	52	34
CCCCCCC(=O)O[C@@H](C)C(=O)O	ZINC000737809208	BD	On-Demand	Anodyne	PRKCA	22	51
CCCCCCC(=O)O[C@@H](C)C(=O)O	ZINC000737809208	BD	On-Demand	Anodyne	LPAR3	44	45
CCCCCCC(=O)O[C@@H](C)C(=O)O	ZINC000737809208	BD	On-Demand	Anodyne	FABP3	34	40
CCCCCCC(=O)O[C@@H](C)C(=O)O	ZINC000737809208	BD	On-Demand	Anodyne	FABP5	16	48
CCCCCCC(=O)O[C@@H](C)C(=O)O	ZINC000737809208	BD	On-Demand	Anodyne	ENPP2	20	40
CCCCCCC(=O)O[C@@H](C)C(=O)O	ZINC000737809208	BD	On-Demand	Anodyne	NOD1	87	44
CCCCCCC(=O)O[C@@H](C)C(=O)O	ZINC000737809208	BD	On-Demand	Anodyne	CQSS	70	47
CCCC[C@H](CC)C(=O)O[C@H](C)C(=O)O	ZINC000737809793	BE	On-Demand	Anodyne	NOD1	42	32
CCCC[C@@H](CC)C(=O)O[C@@H](C)C(=O)O	ZINC000737809794	BE	On-Demand	Anodyne	NOD1	42	32
CCCC[C@H](CC)C(=O)O[C@@H](C)C(=O)O	ZINC000737809795	BE	On-Demand	Anodyne	NOD1	42	32
CCCC[C@@H](CC)C(=O)O[C@H](C)C(=O)O	ZINC000737809797	BE	On-Demand	Anodyne	NOD1	42	32
COCCOC(=O)CCSCC(=O)O	ZINC000737811091	BC	On-Demand	Anodyne	BHMT	23	41
CCCC[C@@H](NC(N)=O)C(=O)NC(C)(C)C(=O)O	ZINC000737812322	CC	On-Demand	Anodyne	NOD1	74	36
CCCC[C@H](NC(N)=O)C(=O)NC(C)(C)C(=O)O	ZINC000737812325	CC	On-Demand	Anodyne	NOD1	74	36
CCCCC[C@@H](CC(=O)O)OC(C)=O	ZINC000737812450	BD	On-Demand	Anodyne	NOD1	48	33
CCCCC[C@@H](CC(=O)O)OC(C)=O	ZINC000737812450	BD	On-Demand	Anodyne	CQSS	50	32
CCCCSCC(=O)OCC(=O)O	ZINC000737817590	BD	On-Demand	Anodyne	PLA2G4B	21	40
CCCCSCC(=O)OCC(=O)O	ZINC000737817590	BD	On-Demand	Anodyne	CES1	19	47
CCCCSCC(=O)OCC(=O)O	ZINC000737817590	BD	On-Demand	Anodyne	EST1_PIG	54	47
CCCCSCCC(=O)NNC(=O)O	ZINC000737817680	BD	On-Demand	Reactive	CES1	17	43
CCCCSCCC(=O)NNC(=O)O	ZINC000737817680	BD	On-Demand	Reactive	EST1_PIG	49	43
CCCCCCCCC/C=C/C(=O)N[C@H](C)C#N	ZINC000737819035	CH	On-Demand	Mild	FABP3	31	40
CCCCCCCCC/C=C/C(=O)N[C@@H](C)C#N	ZINC000737819036	CH	On-Demand	Mild	FABP3	31	40
CCCCCCCCC/C=C\C(=O)N[C@@H](C)C#N	ZINC000737819037	CH	On-Demand	Mild	FABP3	31	40
CCCCCCCCC/C=C\C(=O)N[C@H](C)C#N	ZINC000737819038	CH	On-Demand	Mild	FABP3	31	40
CCCCCCCCC/C=C/C(=O)NNC(=O)N(C)C	ZINC000737820198	CF	On-Demand	Reactive	FABP3	33	42
CCCCCCCCC/C=C\C(=O)NNC(=O)N(C)C	ZINC000737820200	CF	On-Demand	Reactive	FABP3	33	42
CCCCCS(=O)(=O)CC(=O)NNC(=O)O	ZINC000737822411	CB	On-Demand	Reactive	CES2	16	49
CCCCCS(=O)(=O)CC(=O)NNC(=O)O	ZINC000737822411	CB	On-Demand	Reactive	EST1_PIG	29	49
CCCCCCCCC/C=C\C(=O)N(C)CC#N	ZINC000737823267	CH	On-Demand	Mild	FABP3	32	41
CCCCCCCCC/C=C/C(=O)N(C)CC#N	ZINC000737823269	CH	On-Demand	Mild	FABP3	32	41
COCCS(=O)(=O)NC(=O)[C@@H](CC(C)C)NC(=O)O	ZINC000737824907	CB	On-Demand	Anodyne	CAPNS1	57	34
COCCS(=O)(=O)NC(=O)[C@@H](CC(C)C)NC(=O)O	ZINC000737824907	CB	On-Demand	Anodyne	CAPN1	54	38
COCCS(=O)(=O)NC(=O)[C@@H](CC(C)C)NC(=O)O	ZINC000737824907	CB	On-Demand	Anodyne	CAPN2	54	37
COCCS(=O)(=O)NC(=O)[C@@H](CC(C)C)NC(=O)O	ZINC000737824907	CB	On-Demand	Anodyne	FPR1	60	36
COCCS(=O)(=O)NC(=O)[C@@H](CC(C)C)NC(=O)O	ZINC000737824907	CB	On-Demand	Anodyne	NPR	73	34
COCCS(=O)(=O)NC(=O)[C@H](CC(C)C)NC(=O)O	ZINC000737824909	CB	On-Demand	Anodyne	CAPNS1	57	34
COCCS(=O)(=O)NC(=O)[C@H](CC(C)C)NC(=O)O	ZINC000737824909	CB	On-Demand	Anodyne	CAPN1	54	38
COCCS(=O)(=O)NC(=O)[C@H](CC(C)C)NC(=O)O	ZINC000737824909	CB	On-Demand	Anodyne	CAPN2	54	37
COCCS(=O)(=O)NC(=O)[C@H](CC(C)C)NC(=O)O	ZINC000737824909	CB	On-Demand	Anodyne	FPR1	60	36
COCCS(=O)(=O)NC(=O)[C@H](CC(C)C)NC(=O)O	ZINC000737824909	CB	On-Demand	Anodyne	NPR	73	34
CCCN(CC(=O)N(C)C)CC(=O)N(C)CC(=O)O	ZINC000737827332	CB	On-Demand	Anodyne	MVD	23	40
CONC(=O)NCCCCCC(=O)O	ZINC000737838789	BC	On-Demand	Anodyne	EPHX2	28	53
CONC(=O)CCSCC(=O)O	ZINC000737839223	AB	On-Demand	Anodyne	BHMT	43	42
CCOC(=O)[C@@H](NC(=O)[C@@H](C)S(C)(=O)=O)C(=O)O	ZINC000737862657	CA	On-Demand	Anodyne	ENPEP	40	32
CCOC(=O)[C@@H](NC(=O)[C@H](C)S(C)(=O)=O)C(=O)O	ZINC000737862658	CA	On-Demand	Anodyne	ENPEP	40	32
CCOC(=O)[C@@H](NC(=O)[C@@H](C)COC)C(=O)O	ZINC000737863334	BB	On-Demand	Anodyne	NOD1	50	34
CCOC(=O)[C@@H](NC(=O)[C@H](C)COC)C(=O)O	ZINC000737863346	BB	On-Demand	Anodyne	NOD1	50	34
CCOC(=O)CN(C)CC(=O)N(C)CC(=O)O	ZINC000737863854	BB	On-Demand	Anodyne	MVD	23	40
CCOC(=O)N[C@@H](C(=O)O[C@H](C)C(=O)O)C(C)C	ZINC000737865114	CC	On-Demand	Anodyne	HLA-DRB1	41	37
CCOC(=O)N[C@@H](C(=O)O[C@@H](C)C(=O)O)C(C)C	ZINC000737865117	CC	On-Demand	Anodyne	HLA-DRB1	41	37
CCOC(=O)N[C@H](C(=O)O[C@H](C)C(=O)O)C(C)C	ZINC000737865120	CC	On-Demand	Anodyne	HLA-DRB1	41	37
CCOC(=O)N[C@H](C(=O)O[C@@H](C)C(=O)O)C(C)C	ZINC000737865122	CC	On-Demand	Anodyne	HLA-DRB1	41	37
CCOC(=O)[C@@H](NC(=O)[C@@H](C)CSC)C(=O)O	ZINC000737867083	CC	On-Demand	Anodyne	NOD1	41	33
CCOC(=O)[C@@H](NC(=O)[C@H](C)CSC)C(=O)O	ZINC000737867086	CC	On-Demand	Anodyne	NOD1	41	33
CN(C)CCCCC(=O)N(C)CCC(=O)O	ZINC000737950839	BC	On-Demand	Anodyne	KDM2A	40	70
CN(C)CCCCC(=O)N(C)CCC(=O)O	ZINC000737950839	BC	On-Demand	Anodyne	BBOX1	17	41
CN(CC(=O)N(C)C)CC(=O)N(C)CC(=O)O	ZINC000737963972	BA	On-Demand	Anodyne	MVD	24	42
CN(CCC(=O)O)C[Si](C)(C)C	ZINC000737992440	AD	On-Demand	Anodyne	KDM2A	42	42
CN(CCCC(=O)NC(N)=O)CCC(=O)O	ZINC000737992862	BB	On-Demand	Anodyne	KDM2A	40	38
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@](C)(O)CSC	ZINC000737994187	DC	On-Demand	Anodyne	PAPA1_CARPA	45	41
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@](C)(O)CSC	ZINC000737994187	DC	On-Demand	Anodyne	CTSK	32	52
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@](C)(O)CSC	ZINC000737994187	DC	On-Demand	Anodyne	CTSL	27	42
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@](C)(O)CSC	ZINC000737994187	DC	On-Demand	Anodyne	CAPNS1	54	35
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@](C)(O)CSC	ZINC000737994187	DC	On-Demand	Anodyne	CTSS	20	52
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@](C)(O)CSC	ZINC000737994187	DC	On-Demand	Anodyne	CAPN1	66	47
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@](C)(O)CSC	ZINC000737994187	DC	On-Demand	Anodyne	CAPN2	85	37
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@](C)(O)CSC	ZINC000737994187	DC	On-Demand	Anodyne	FPR1	68	41
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@](C)(O)CSC	ZINC000737994187	DC	On-Demand	Anodyne	NPR	61	38
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@@](C)(O)CSC	ZINC000737994188	DC	On-Demand	Anodyne	PAPA1_CARPA	45	41
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@@](C)(O)CSC	ZINC000737994188	DC	On-Demand	Anodyne	CTSK	32	52
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@@](C)(O)CSC	ZINC000737994188	DC	On-Demand	Anodyne	CTSL	27	42
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@@](C)(O)CSC	ZINC000737994188	DC	On-Demand	Anodyne	CAPNS1	54	35
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@@](C)(O)CSC	ZINC000737994188	DC	On-Demand	Anodyne	CTSS	20	52
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@@](C)(O)CSC	ZINC000737994188	DC	On-Demand	Anodyne	CAPN1	66	47
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@@](C)(O)CSC	ZINC000737994188	DC	On-Demand	Anodyne	CAPN2	85	37
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@@](C)(O)CSC	ZINC000737994188	DC	On-Demand	Anodyne	FPR1	68	41
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@@](C)(O)CSC	ZINC000737994188	DC	On-Demand	Anodyne	NPR	61	38