CCCCCCCCNC(=O)N[C@@H](C)CO	ZINC000755000499	BE	On-Demand	Mild	EPHX2	25	45
CCCCCCCCNC(=O)N[C@@H](C)CO	ZINC000755000499	BE	On-Demand	Mild	ASAH1	87	37
CCCCCCCCNC(=O)N[C@@H](C)CO	ZINC000755000499	BE	On-Demand	Mild	NOD1	47	38
CCCCCCCCNC(=O)N[C@@H](C)CO	ZINC000755000499	BE	On-Demand	Mild	CQSS	54	36
CCCCSCC(=O)N(CCC)C(C)(C)C	ZINC000755025029	BH	On-Demand	Anodyne	CES2	15	45
CCCCSCC(=O)N(CCC)C(C)(C)C	ZINC000755025029	BH	On-Demand	Anodyne	CES1	20	49
CCCCSCC(=O)N(CCC)C(C)(C)C	ZINC000755025029	BH	On-Demand	Anodyne	EST1_PIG	56	49
CCCCCCC(=O)N(CCC)C(C)(C)C	ZINC000755026748	BH	On-Demand	Anodyne	CES2	49	42
CCCCCCC(=O)N(CCC)C(C)(C)C	ZINC000755026748	BH	On-Demand	Anodyne	CES1	27	42
CCCCCCC(=O)N(CCC)C(C)(C)C	ZINC000755026748	BH	On-Demand	Anodyne	EST1_PIG	64	42
CCCCCCC(=O)N(CCC)C(C)(C)C	ZINC000755026748	BH	On-Demand	Anodyne	CES2C	55	33
CCCCCCC(=O)N(CCC)C(C)(C)C	ZINC000755026748	BH	On-Demand	Anodyne	FABP5	15	43
CCCCCCC(=O)N(CCC)C(C)(C)C	ZINC000755026748	BH	On-Demand	Anodyne	CQSS	62	38
CCCCC[C@@H](C(=O)N[C@H](C)CC)C(C)C	ZINC000755034010	BH	On-Demand	Anodyne	NOD1	43	35
CCCCC[C@@H](C(=O)N[C@H](C)CC)C(C)C	ZINC000755034010	BH	On-Demand	Anodyne	CQSS	54	34
CCCCC[C@@H](C(=O)N[C@@H](C)CC)C(C)C	ZINC000755034013	BH	On-Demand	Anodyne	NOD1	43	35
CCCCC[C@@H](C(=O)N[C@@H](C)CC)C(C)C	ZINC000755034013	BH	On-Demand	Anodyne	CQSS	54	34
CCCCC[C@@H](C(=O)N(CC)CC)C(C)C	ZINC000755034104	BH	On-Demand	Anodyne	CQSS	52	34
CCCCC[C@@H](C(=O)NCC)C(C)C	ZINC000755034214	AF	On-Demand	Anodyne	NOD1	57	37
CCCCC[C@@H](C(=O)NCC)C(C)C	ZINC000755034214	AF	On-Demand	Anodyne	CQSS	53	34
CCCCC[C@@H](C(=O)NCCCC)C(C)C	ZINC000755034419	BH	On-Demand	Anodyne	ASAH1	75	33
CCCCC[C@@H](C(=O)NCCCC)C(C)C	ZINC000755034419	BH	On-Demand	Anodyne	NOD1	61	40
CCCCC[C@@H](C(=O)NCCCC)C(C)C	ZINC000755034419	BH	On-Demand	Anodyne	CQSS	53	34
CCCCC[C@@H](C(=O)NNC(=O)OC(C)(C)C)C(C)C	ZINC000755037178	CG	On-Demand	Reactive	PDF	40	36
CCCCC[C@@H](C(=O)NNC(=O)OC(C)(C)C)C(C)C	ZINC000755037178	CG	On-Demand	Reactive	CTSK	20	50
CCCCC[C@@H](C(=O)NNC(=O)OC(C)(C)C)C(C)C	ZINC000755037178	CG	On-Demand	Reactive	PGA5	31	54
CCCCC[C@@H](C(=O)NNC(=O)C(C)C)C(C)C	ZINC000755046216	CF	On-Demand	Reactive	CQSS	52	33
CCCCC[C@@H](C)NC(=O)CN[C@@H](C)COC	ZINC000755051560	BD	On-Demand	Anodyne	NOD1	70	35
CCCCC[C@@H](C)NC(=O)CN[C@H](C)COC	ZINC000755051572	BD	On-Demand	Anodyne	NOD1	70	35
CCCCCCCCNC(=O)NCCC(N)=O	ZINC000755052581	BD	On-Demand	Mild	EPHX2	32	54
CCCCCCCCNC(=O)NCCC(N)=O	ZINC000755052581	BD	On-Demand	Mild	ASAH1	91	36
CCCCCCCCNC(=O)NCCC(N)=O	ZINC000755052581	BD	On-Demand	Mild	NOD1	45	37
CCCCCCCCNC(=O)NCCC(N)=O	ZINC000755052581	BD	On-Demand	Mild	CQSS	57	36
CCCCC[C@@H](C(=O)NCC(C)(C)N(C)C)C(C)C	ZINC000755055468	CG	On-Demand	Anodyne	PDF	53	39
CCCCC[C@@H](C(=O)N[C@H](C)C(=O)NCC)C(C)C	ZINC000755061257	CE	On-Demand	Anodyne	PGA	43	37
CCCCC[C@@H](C(=O)N[C@H](C)C(=O)NCC)C(C)C	ZINC000755061257	CE	On-Demand	Anodyne	NOD1	58	36
CCCCC[C@@H](C(=O)N[C@@H](C)C(=O)NCC)C(C)C	ZINC000755061263	CE	On-Demand	Anodyne	PGA	43	37
CCCCC[C@@H](C(=O)N[C@@H](C)C(=O)NCC)C(C)C	ZINC000755061263	CE	On-Demand	Anodyne	NOD1	58	36
CCCCC[C@@H](C(=O)NCC(C)(C)CN(C)C)C(C)C	ZINC000755062387	CH	On-Demand	Anodyne	PDF	41	37
CCCCC[C@@H](C(=O)NNC(=O)C(=O)NC(C)C)C(C)C	ZINC000755062413	CD	On-Demand	Reactive	CQSS	51	33
CCCCCCCCNC(=O)NCC(C)(C)C(N)=O	ZINC000755064195	CE	On-Demand	Mild	EPHX2	21	48
CCCCCCCCNC(=O)NCC(C)(C)C(N)=O	ZINC000755064195	CE	On-Demand	Mild	ASAH1	83	33
CCCCCCCCNC(=O)NCCS(N)(=O)=O	ZINC000755064285	CC	On-Demand	Mild	EPHX2	24	58
CCCCCCCCNC(=O)NCCS(N)(=O)=O	ZINC000755064285	CC	On-Demand	Mild	ASAH1	83	35
CCCCC[C@@H](C(=O)NCC(C)C)C(C)C	ZINC000755065175	BH	On-Demand	Anodyne	CQSS	50	32
CCCCCCCCNC(=O)N[C@H](C)CCO	ZINC000755068111	BE	On-Demand	Mild	EPHX2	24	44
CCCCCCCCNC(=O)N[C@H](C)CCO	ZINC000755068111	BE	On-Demand	Mild	ASAH1	85	36
CCCCCCCCNC(=O)N[C@H](C)CCO	ZINC000755068111	BE	On-Demand	Mild	NOD1	78	40
CCCCCCCCNC(=O)N[C@H](C)CCO	ZINC000755068111	BE	On-Demand	Mild	CQSS	54	35
CCCCCCCCNC(=O)N[C@@H](C)CCO	ZINC000755068112	BE	On-Demand	Mild	EPHX2	24	44
CCCCCCCCNC(=O)N[C@@H](C)CCO	ZINC000755068112	BE	On-Demand	Mild	ASAH1	85	36
CCCCCCCCNC(=O)N[C@@H](C)CCO	ZINC000755068112	BE	On-Demand	Mild	NOD1	78	40
CCCCCCCCNC(=O)N[C@@H](C)CCO	ZINC000755068112	BE	On-Demand	Mild	CQSS	54	35
C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)OCC(F)(F)F	ZINC000755070471	DE	On-Demand	Anodyne	CTSK	16	42
C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)N(C)C	ZINC000755070633	BD	On-Demand	Anodyne	CTSK	18	49
C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)C(=O)OC(C)(C)C	ZINC000755072756	DD	On-Demand	Anodyne	CTSK	16	46
C#CCN(CC)C(=O)NCCCCCCCC	ZINC000755074070	BG	On-Demand	Mild	ASAH1	67	32
CCCCCCCCNC(=O)N(C[C@H](C)O)C(C)C	ZINC000755074256	CG	On-Demand	Mild	ASAH1	94	35
CCCCCCCCNC(=O)N(C[C@H](C)O)C(C)C	ZINC000755074256	CG	On-Demand	Mild	CQSS	54	37
CCCCCCCCNC(=O)N(C[C@@H](C)O)C(C)C	ZINC000755074257	CG	On-Demand	Mild	ASAH1	94	35
CCCCCCCCNC(=O)N(C[C@@H](C)O)C(C)C	ZINC000755074257	CG	On-Demand	Mild	CQSS	54	37
CCCCCCCCNC(=O)N(CC)CC(C)(C)O	ZINC000755074262	CG	On-Demand	Mild	ASAH1	68	32
CCCCCCCCNC(=O)N(C)C(C)C	ZINC000755074842	BG	On-Demand	Mild	EST1_PIG	44	36
CCCCCCCCNC(=O)N(C)C(C)C	ZINC000755074842	BG	On-Demand	Mild	ASAH1	98	37
CCCCCCCCNC(=O)N(C)C(C)C	ZINC000755074842	BG	On-Demand	Mild	NOD1	67	39
CCCCCCCCNC(=O)N(C)C(C)C	ZINC000755074842	BG	On-Demand	Mild	CQSS	55	37
CCCCCCCCNC(=O)N(C)C[C@H](C)C#N	ZINC000755074974	CG	On-Demand	Mild	ASAH1	52	31
CCCCCCCCNC(=O)N(C)C[C@@H](C)C#N	ZINC000755074982	CG	On-Demand	Mild	ASAH1	52	31
CCCCCCCCNC(=O)N(C)[C@H](C)CC	ZINC000755075093	BH	On-Demand	Mild	ASAH1	98	37
CCCCCCCCNC(=O)N(C)[C@H](C)CC	ZINC000755075093	BH	On-Demand	Mild	NOD1	54	38
CCCCCCCCNC(=O)N(C)[C@H](C)CC	ZINC000755075093	BH	On-Demand	Mild	CQSS	57	36
CCCCCCCCNC(=O)N(C)[C@@H](C)CC	ZINC000755075095	BH	On-Demand	Mild	ASAH1	98	37
CCCCCCCCNC(=O)N(C)[C@@H](C)CC	ZINC000755075095	BH	On-Demand	Mild	NOD1	54	38
CCCCCCCCNC(=O)N(C)[C@@H](C)CC	ZINC000755075095	BH	On-Demand	Mild	CQSS	57	36
CCCCCCCCNC(=O)N(CC)CCO	ZINC000755075542	BE	On-Demand	Mild	ASAH1	77	33
CCCCCCCCNC(=O)N(C)CCC(=O)NC	ZINC000755075673	CE	On-Demand	Mild	ASAH1	64	31
CCCCCCCCNC(=O)NCCCO	ZINC000755075729	BE	On-Demand	Mild	CES2	47	40
CCCCCCCCNC(=O)NCCCO	ZINC000755075729	BE	On-Demand	Mild	S1PR2	15	40
CCCCCCCCNC(=O)NCCCO	ZINC000755075729	BE	On-Demand	Mild	CES1	44	33
CCCCCCCCNC(=O)NCCCO	ZINC000755075729	BE	On-Demand	Mild	EST1_PIG	63	40
CCCCCCCCNC(=O)NCCCO	ZINC000755075729	BE	On-Demand	Mild	EPHX2	30	54
CCCCCCCCNC(=O)NCCCO	ZINC000755075729	BE	On-Demand	Mild	CES2C	56	40
CCCCCCCCNC(=O)NCCCO	ZINC000755075729	BE	On-Demand	Mild	ASAH1	98	39
CCCCCCCCNC(=O)NCCCO	ZINC000755075729	BE	On-Demand	Mild	CQSS	54	33
CCCCCCCCNC(=O)N(CC)C(C)C	ZINC000755075831	BH	On-Demand	Mild	FDPS	23	42
CCCCCCCCNC(=O)N(CC)C(C)C	ZINC000755075831	BH	On-Demand	Mild	S1PR3	17	45
CCCCCCCCNC(=O)N(CC)C(C)C	ZINC000755075831	BH	On-Demand	Mild	S1PR2	19	45
CCCCCCCCNC(=O)N(CC)C(C)C	ZINC000755075831	BH	On-Demand	Mild	EST1_PIG	50	31
CCCCCCCCNC(=O)N(CC)C(C)C	ZINC000755075831	BH	On-Demand	Mild	LPAR3	26	40
CCCCCCCCNC(=O)N(CC)C(C)C	ZINC000755075831	BH	On-Demand	Mild	ASAH1	99	37
CCCCCCCCNC(=O)N(CC)C(C)C	ZINC000755075831	BH	On-Demand	Mild	NOD1	54	38
CCCCCCCCNC(=O)N(CC)C(C)C	ZINC000755075831	BH	On-Demand	Mild	CQSS	54	36
CCCCCCCCNC(=O)NNC(=O)CC(F)(F)F	ZINC000755076377	CF	On-Demand	Reactive	CES2	52	43
CCCCCCCCNC(=O)NNC(=O)CC(F)(F)F	ZINC000755076377	CF	On-Demand	Reactive	CES1	50	37
CCCCCCCCNC(=O)NNC(=O)CC(F)(F)F	ZINC000755076377	CF	On-Demand	Reactive	EST1_PIG	74	43
CCCCCCCCNC(=O)NNC(=O)CC(F)(F)F	ZINC000755076377	CF	On-Demand	Reactive	EPHX2	18	42
CCCCCCCCNC(=O)NNC(=O)CC(F)(F)F	ZINC000755076377	CF	On-Demand	Reactive	CES2C	62	43
CCCCCCCCNC(=O)NNC(=O)CC(F)(F)F	ZINC000755076377	CF	On-Demand	Reactive	ASAH1	93	38
CCCCCCCCNC(=O)N[C@H](C)CO	ZINC000755076410	BE	On-Demand	Mild	EPHX2	25	45
CCCCCCCCNC(=O)N[C@H](C)CO	ZINC000755076410	BE	On-Demand	Mild	ASAH1	87	37
CCCCCCCCNC(=O)N[C@H](C)CO	ZINC000755076410	BE	On-Demand	Mild	NOD1	47	38
CCCCCCCCNC(=O)N[C@H](C)CO	ZINC000755076410	BE	On-Demand	Mild	CQSS	54	36
CCCCCCCCNC(=O)NC(CO)CO	ZINC000755076784	BC	On-Demand	Mild	S1PR2	15	40
CCCCCCCCNC(=O)NC(CO)CO	ZINC000755076784	BC	On-Demand	Mild	EPHX2	25	46
CCCCCCCCNC(=O)NC(CO)CO	ZINC000755076784	BC	On-Demand	Mild	ASAH1	94	38
CCCCCCCCNC(=O)NC(CO)CO	ZINC000755076784	BC	On-Demand	Mild	NOD1	44	36
CCCCCCCCNC(=O)NC(CO)CO	ZINC000755076784	BC	On-Demand	Mild	CQSS	54	33
CCC(CC)S(=O)(=O)NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)CC	ZINC000755076897	FF	On-Demand	Anodyne	CTSD	21	50
CCC(CC)S(=O)(=O)NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)CC	ZINC000755076897	FF	On-Demand	Anodyne	PAPA1_CARPA	28	42
CCC(CC)S(=O)(=O)NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)CC	ZINC000755076897	FF	On-Demand	Anodyne	CTSK	16	48
CCC(CC)S(=O)(=O)NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)CC	ZINC000755076897	FF	On-Demand	Anodyne	ECE1	43	50
CCC(CC)S(=O)(=O)NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)CC	ZINC000755076897	FF	On-Demand	Anodyne	ENPEP	42	32
CCC(CC)S(=O)(=O)NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)CC	ZINC000755076897	FF	On-Demand	Anodyne	PGA5	27	40
CCC(CC)S(=O)(=O)NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)CC	ZINC000755076897	FF	On-Demand	Anodyne	POLG_HCV1	25	46
CCCCCCCCNC(=O)NCC(C)(C)O	ZINC000755077052	BE	On-Demand	Mild	CES2	47	39
CCCCCCCCNC(=O)NCC(C)(C)O	ZINC000755077052	BE	On-Demand	Mild	CES1	44	33
CCCCCCCCNC(=O)NCC(C)(C)O	ZINC000755077052	BE	On-Demand	Mild	EST1_PIG	64	39
CCCCCCCCNC(=O)NCC(C)(C)O	ZINC000755077052	BE	On-Demand	Mild	EPHX2	24	49
CCCCCCCCNC(=O)NCC(C)(C)O	ZINC000755077052	BE	On-Demand	Mild	CES2C	56	39
CCCCCCCCNC(=O)NCC(C)(C)O	ZINC000755077052	BE	On-Demand	Mild	ASAH1	87	35
CCCCCCCCNC(=O)NCC(C)(C)O	ZINC000755077052	BE	On-Demand	Mild	CQSS	48	30
CCCCCCCCNC(=O)NCC[C@@H](C)O	ZINC000755078001	BE	On-Demand	Mild	S1PR2	22	40
CCCCCCCCNC(=O)NCC[C@@H](C)O	ZINC000755078001	BE	On-Demand	Mild	EPHX2	27	49
CCCCCCCCNC(=O)NCC[C@@H](C)O	ZINC000755078001	BE	On-Demand	Mild	ASAH1	94	35
CCCCCCCCNC(=O)NCC[C@@H](C)O	ZINC000755078001	BE	On-Demand	Mild	NOD1	60	39
CCCCCCCCNC(=O)NCC[C@@H](C)O	ZINC000755078001	BE	On-Demand	Mild	CQSS	62	41
CCCCCCCCNC(=O)NCC[C@H](C)O	ZINC000755078005	BE	On-Demand	Mild	S1PR2	22	40
CCCCCCCCNC(=O)NCC[C@H](C)O	ZINC000755078005	BE	On-Demand	Mild	EPHX2	27	49
CCCCCCCCNC(=O)NCC[C@H](C)O	ZINC000755078005	BE	On-Demand	Mild	ASAH1	94	35
CCCCCCCCNC(=O)NCC[C@H](C)O	ZINC000755078005	BE	On-Demand	Mild	NOD1	60	39
CCCCCCCCNC(=O)NCC[C@H](C)O	ZINC000755078005	BE	On-Demand	Mild	CQSS	62	41
CCCCCCCCNC(=O)N[C@H](CC)CO	ZINC000755078074	BE	On-Demand	Mild	EPHX2	23	44
CCCCCCCCNC(=O)N[C@H](CC)CO	ZINC000755078074	BE	On-Demand	Mild	ASAH1	81	36
CCCCCCCCNC(=O)N[C@H](CC)CO	ZINC000755078074	BE	On-Demand	Mild	CQSS	55	34
CCCCCCCCNC(=O)N[C@@H](CC)CO	ZINC000755078077	BE	On-Demand	Mild	EPHX2	23	44
CCCCCCCCNC(=O)N[C@@H](CC)CO	ZINC000755078077	BE	On-Demand	Mild	ASAH1	81	36
CCCCCCCCNC(=O)N[C@@H](CC)CO	ZINC000755078077	BE	On-Demand	Mild	CQSS	55	34
CCCCCCCCNC(=O)NC[C@@H](O)C(C)(C)C	ZINC000755078737	CG	On-Demand	Mild	EPHX2	22	49
CCCCCCCCNC(=O)NC[C@@H](O)C(C)(C)C	ZINC000755078737	CG	On-Demand	Mild	ASAH1	79	33
CCCCCCCCNC(=O)NC[C@@H](O)C(C)(C)C	ZINC000755078737	CG	On-Demand	Mild	CQSS	54	34
CCCCCCCCNC(=O)NC[C@H](O)C(C)(C)C	ZINC000755078738	CG	On-Demand	Mild	EPHX2	22	49
CCCCCCCCNC(=O)NC[C@H](O)C(C)(C)C	ZINC000755078738	CG	On-Demand	Mild	ASAH1	79	33
CCCCCCCCNC(=O)NC[C@H](O)C(C)(C)C	ZINC000755078738	CG	On-Demand	Mild	CQSS	54	34
CCCCCCCCNC(=O)N(CC)CCC	ZINC000755079469	BH	On-Demand	Mild	ASAH1	86	35
CCCCCCCCNC(=O)N(CC)CCC	ZINC000755079469	BH	On-Demand	Mild	CQSS	48	30
CCCCCCCCNC(=O)NNC(=O)OC(C)(C)C	ZINC000755079574	CG	On-Demand	Reactive	EPHX2	21	42
CCCCCCCCNC(=O)NNC(=O)OC(C)(C)C	ZINC000755079574	CG	On-Demand	Reactive	PGA5	22	40
CCCCCCCCNC(=O)NNC(=O)OC(C)(C)C	ZINC000755079574	CG	On-Demand	Reactive	ASAH1	75	35
CCCCCCCCNC(=O)NC[C@](C)(O)C(C)C	ZINC000755079593	CG	On-Demand	Mild	EPHX2	21	44
CCCCCCCCNC(=O)NC[C@](C)(O)C(C)C	ZINC000755079593	CG	On-Demand	Mild	ASAH1	78	32
CCCCCCCCNC(=O)NC[C@](C)(O)C(C)C	ZINC000755079593	CG	On-Demand	Mild	CQSS	50	33
CCCCCCCCNC(=O)NC[C@@](C)(O)C(C)C	ZINC000755079594	CG	On-Demand	Mild	EPHX2	21	44
CCCCCCCCNC(=O)NC[C@@](C)(O)C(C)C	ZINC000755079594	CG	On-Demand	Mild	ASAH1	78	32
CCCCCCCCNC(=O)NC[C@@](C)(O)C(C)C	ZINC000755079594	CG	On-Demand	Mild	CQSS	50	33
CCCCCCCCNC(=O)NC(C)(C)COC	ZINC000755079873	CG	On-Demand	Mild	CES2	48	39
CCCCCCCCNC(=O)NC(C)(C)COC	ZINC000755079873	CG	On-Demand	Mild	EST1_PIG	63	39
CCCCCCCCNC(=O)NC(C)(C)COC	ZINC000755079873	CG	On-Demand	Mild	EPHX2	29	45
CCCCCCCCNC(=O)NC(C)(C)COC	ZINC000755079873	CG	On-Demand	Mild	CES2C	57	39
CCCCCCCCNC(=O)NC(C)(C)COC	ZINC000755079873	CG	On-Demand	Mild	ASAH1	81	36
CCCCC[C@@H](C)NC(=O)C[C@H](C)COC	ZINC000755082204	BF	On-Demand	Anodyne	NOD1	80	36
CCCCC[C@@H](C)NC(=O)C[C@@H](C)COC	ZINC000755082208	BF	On-Demand	Anodyne	NOD1	80	36
CCC(CC)CS(=O)(=O)NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)CC	ZINC000755083570	GF	On-Demand	Anodyne	CTSD	20	48
CCC(CC)CS(=O)(=O)NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)CC	ZINC000755083570	GF	On-Demand	Anodyne	PAPA1_CARPA	23	40
CCC(CC)CS(=O)(=O)NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)CC	ZINC000755083570	GF	On-Demand	Anodyne	ECE1	42	48
CCC(CC)CS(=O)(=O)NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)CC	ZINC000755083570	GF	On-Demand	Anodyne	ENPEP	58	33
CCC(CC)CS(=O)(=O)NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)CC	ZINC000755083570	GF	On-Demand	Anodyne	PGA5	27	40
CCC(CC)CS(=O)(=O)NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)CC	ZINC000755083570	GF	On-Demand	Anodyne	POLG_HCV1	17	45
C=C(C)CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)CC	ZINC000755085620	CG	On-Demand	Mild	CTSD	16	45
C=C(C)CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)CC	ZINC000755085620	CG	On-Demand	Mild	CTSK	18	49
C=C(C)CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)CC	ZINC000755085620	CG	On-Demand	Mild	ECE1	37	45
C=C(C)CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)CC	ZINC000755085620	CG	On-Demand	Mild	POLG_HCV1	17	41
CCCCCCCCCCNC(=O)NOC	ZINC000755090375	BF	On-Demand	Mild	S1PR2	22	45
CCCCCCCCCCNC(=O)NOC	ZINC000755090375	BF	On-Demand	Mild	EPHX2	33	49
CCCCCCCCCCNC(=O)NOC	ZINC000755090375	BF	On-Demand	Mild	ASAH1	96	38
CCCCCCCCCCNC(=O)NOC	ZINC000755090375	BF	On-Demand	Mild	CQSS	53	33
CCCN(C)S(=O)(=O)NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C	ZINC000755096905	FD	On-Demand	Anodyne	PAPA1_CARPA	37	50
CCCN(C)S(=O)(=O)NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C	ZINC000755096905	FD	On-Demand	Anodyne	CTSK	21	51
CCCN(C)S(=O)(=O)NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C	ZINC000755096905	FD	On-Demand	Anodyne	REN	24	41
CCCN(C)S(=O)(=O)NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C	ZINC000755096905	FD	On-Demand	Anodyne	CAPN1	25	49
CCCN(C)S(=O)(=O)NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C	ZINC000755096905	FD	On-Demand	Anodyne	POLG_HCV1	25	42
CCCN(C)S(=O)(=O)NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C	ZINC000755096905	FD	On-Demand	Anodyne	FPR1	53	41
CCCN(C)S(=O)(=O)NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)CC	ZINC000755100124	FD	On-Demand	Anodyne	CTSD	17	46
CCCN(C)S(=O)(=O)NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)CC	ZINC000755100124	FD	On-Demand	Anodyne	ECE1	38	46
CCCCSCC(=O)OCCOC(C)(C)C	ZINC000755101371	BF	On-Demand	Anodyne	CES1	19	46
CCCCSCC(=O)OCCOC(C)(C)C	ZINC000755101371	BF	On-Demand	Anodyne	EST1_PIG	53	46
CCCCC[C@@H](C(=O)NNC(=O)CC(C)C)C(C)C	ZINC000755113237	CG	On-Demand	Reactive	PGA	64	51
CCCCC[C@@H](C(=O)N(C)C)C(C)C	ZINC000755116693	AF	On-Demand	Anodyne	PDF	50	43
CCCCC[C@@H](C(=O)N(C)C)C(C)C	ZINC000755116693	AF	On-Demand	Anodyne	CQSS	53	35
CCCC[C@@H](NC(=O)[C@@H](C)NC(=O)C(C)(C)C)C(=O)NOC	ZINC000755123697	DC	On-Demand	Anodyne	NOD1	54	32
CCCC[C@H](NC(=O)[C@@H](C)NC(=O)C(C)(C)C)C(=O)NOC	ZINC000755123698	DC	On-Demand	Anodyne	NOD1	54	32
CCCC[C@H](NC(=O)[C@H](C)NC(=O)C(C)(C)C)C(=O)NOC	ZINC000755123699	DC	On-Demand	Anodyne	NOD1	54	32
CCCC[C@@H](NC(=O)[C@H](C)NC(=O)C(C)(C)C)C(=O)NOC	ZINC000755123700	DC	On-Demand	Anodyne	NOD1	54	32
CCCCNC(=O)NC(=O)COC(=O)[C@H](C)CCC(C)(C)C	ZINC000755139397	DF	On-Demand	Anodyne	NOD1	63	34
CCCCNC(=O)NC(=O)COC(=O)[C@@H](C)CCC(C)(C)C	ZINC000755139398	DF	On-Demand	Anodyne	NOD1	63	34
CCCCC[C@@H](C(=O)N(C)CC)C(C)C	ZINC000755143094	BG	On-Demand	Anodyne	CQSS	54	35
CCCCCCCCNC(=O)C(C)=C(C)C	ZINC000755146076	BH	On-Demand	Mild	EPHX2	15	43
CCCCCCCCNC(=O)C(C)=C(C)C	ZINC000755146076	BH	On-Demand	Mild	ASAH1	95	37
CCCCCCCCNC(=O)C(C)=C(C)C	ZINC000755146076	BH	On-Demand	Mild	CQSS	52	32
CCCCCCCCNC(=O)[C@@H](NS(C)(=O)=O)C(C)(C)C	ZINC000755146136	DE	On-Demand	Mild	ASAH1	82	34
CCCCCCCCNC(=O)[C@H](NS(C)(=O)=O)C(C)(C)C	ZINC000755146138	DE	On-Demand	Mild	ASAH1	82	34
CCCCCCCCNC(=O)C(=O)C(C)(C)C	ZINC000755147589	BG	On-Demand	Mild	CES2	50	42
CCCCCCCCNC(=O)C(=O)C(C)(C)C	ZINC000755147589	BG	On-Demand	Mild	EST1_PIG	66	42
CCCCCCCCNC(=O)C(=O)C(C)(C)C	ZINC000755147589	BG	On-Demand	Mild	CES2C	59	42
CCCCCCCCNC(=O)C(=O)C(C)(C)C	ZINC000755147589	BG	On-Demand	Mild	ASAH1	93	36
CCCCCCCCNC(=O)C(=O)C(C)(C)C	ZINC000755147589	BG	On-Demand	Mild	CQSS	57	35
CCCCCCCCNC(=O)C(C)(C)S(C)(=O)=O	ZINC000755148501	CE	On-Demand	Mild	CES2	44	42
CCCCCCCCNC(=O)C(C)(C)S(C)(=O)=O	ZINC000755148501	CE	On-Demand	Mild	EST1_PIG	52	42
CCCCCCCCNC(=O)C(C)(C)S(C)(=O)=O	ZINC000755148501	CE	On-Demand	Mild	CES2C	49	42
CCCCCCCCNC(=O)C(C)(C)S(C)(=O)=O	ZINC000755148501	CE	On-Demand	Mild	ASAH1	79	35
CC[C@H](C)NC(=O)[C@@H](C)NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)CC	ZINC000755164889	FE	On-Demand	Anodyne	CTSD	30	54
CC[C@H](C)NC(=O)[C@@H](C)NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)CC	ZINC000755164889	FE	On-Demand	Anodyne	PAPA1_CARPA	46	38
CC[C@H](C)NC(=O)[C@@H](C)NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)CC	ZINC000755164889	FE	On-Demand	Anodyne	CTSK	19	49
CC[C@H](C)NC(=O)[C@@H](C)NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)CC	ZINC000755164889	FE	On-Demand	Anodyne	PGA	24	43
CC[C@H](C)NC(=O)[C@@H](C)NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)CC	ZINC000755164889	FE	On-Demand	Anodyne	HLA-A	15	40
CC[C@H](C)NC(=O)[C@@H](C)NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)CC	ZINC000755164889	FE	On-Demand	Anodyne	ECE1	49	55
CC[C@H](C)NC(=O)[C@@H](C)NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)CC	ZINC000755164889	FE	On-Demand	Anodyne	ENPEP	51	31
CC[C@H](C)NC(=O)[C@@H](C)NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)CC	ZINC000755164889	FE	On-Demand	Anodyne	PGA5	33	43
CC[C@H](C)NC(=O)[C@@H](C)NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)CC	ZINC000755164889	FE	On-Demand	Anodyne	POLG_HCV1	27	50
CC[C@H](C)NC(=O)[C@@H](C)NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)CC	ZINC000755164889	FE	On-Demand	Anodyne	PSMB5	26	43
C[C@@H](CNC(=O)OC(C)(C)C)NS(=O)(=O)CCCC#N	ZINC000755167004	DD	On-Demand	Mild	PAPA1_CARPA	36	40
CCCCCC(C)(C)CNC(=O)NCCC(F)(F)F	ZINC000755177441	CH	On-Demand	Anodyne	CES2	47	38
CCCCCC(C)(C)CNC(=O)NCCC(F)(F)F	ZINC000755177441	CH	On-Demand	Anodyne	EST1_PIG	61	35
CCCCCC(C)(C)CNC(=O)NCCC(F)(F)F	ZINC000755177441	CH	On-Demand	Anodyne	CES2C	56	38
C[C@@H](CNC(=O)OC(C)(C)C)NS(=O)(=O)CCCCC#N	ZINC000755183832	DD	On-Demand	Mild	PAPA1_CARPA	33	40
CCCCCC(C)(C)CNC(=O)NCC(C)(C)C[C@H](C)O	ZINC000755199656	DH	On-Demand	Anodyne	CQSS	56	36
CCCCCC(C)(C)CNC(=O)NCC(C)(C)C[C@@H](C)O	ZINC000755199664	DH	On-Demand	Anodyne	CQSS	56	36
CCCCCCCCNC(=O)CN(C)C(C)C	ZINC000755213254	BF	On-Demand	Mild	ASAH1	85	33
CCCCCCCCNC(=O)CN(C)C(C)C	ZINC000755213254	BF	On-Demand	Mild	NOD1	55	40
CCCCCCCCNC(=O)CN(C)C(C)C	ZINC000755213254	BF	On-Demand	Mild	CQSS	52	35
CCCCCCCCNC(=O)[C@](C)(O)COC	ZINC000755214453	BD	On-Demand	Mild	ASAH1	86	35
CCCCCCCCNC(=O)[C@@](C)(O)COC	ZINC000755214454	BD	On-Demand	Mild	ASAH1	86	35
CCCCCCCCNC(=O)C[C@@H](O)C(C)C	ZINC000755216000	BF	On-Demand	Mild	EPHX2	15	44
CCCCCCCCNC(=O)C[C@@H](O)C(C)C	ZINC000755216000	BF	On-Demand	Mild	ASAH1	88	36
CCCCCCCCNC(=O)C[C@@H](O)C(C)C	ZINC000755216000	BF	On-Demand	Mild	NOD1	48	41
CCCCCCCCNC(=O)C[C@@H](O)C(C)C	ZINC000755216000	BF	On-Demand	Mild	CQSS	59	40
CCCCCCCCNC(=O)C[C@H](O)C(C)C	ZINC000755216001	BF	On-Demand	Mild	EPHX2	15	44
CCCCCCCCNC(=O)C[C@H](O)C(C)C	ZINC000755216001	BF	On-Demand	Mild	ASAH1	88	36
CCCCCCCCNC(=O)C[C@H](O)C(C)C	ZINC000755216001	BF	On-Demand	Mild	NOD1	48	41
CCCCCCCCNC(=O)C[C@H](O)C(C)C	ZINC000755216001	BF	On-Demand	Mild	CQSS	59	40
CCCCCCCCNC(=O)[C@H](C)N(C)C	ZINC000755216465	BE	On-Demand	Mild	S1PR3	15	45
CCCCCCCCNC(=O)[C@H](C)N(C)C	ZINC000755216465	BE	On-Demand	Mild	S1PR2	25	45
CCCCCCCCNC(=O)[C@H](C)N(C)C	ZINC000755216465	BE	On-Demand	Mild	EPHX2	16	41
CCCCCCCCNC(=O)[C@H](C)N(C)C	ZINC000755216465	BE	On-Demand	Mild	ASAH1	97	36
CCCCCCCCNC(=O)[C@H](C)N(C)C	ZINC000755216465	BE	On-Demand	Mild	NOD1	54	40
CCCCCCCCNC(=O)[C@H](C)N(C)C	ZINC000755216465	BE	On-Demand	Mild	CQSS	60	39
CCCCCCCCNC(=O)[C@@](C)(O)CCC	ZINC000755216588	BG	On-Demand	Mild	CES2	49	39
CCCCCCCCNC(=O)[C@@](C)(O)CCC	ZINC000755216588	BG	On-Demand	Mild	CES1	45	33
CCCCCCCCNC(=O)[C@@](C)(O)CCC	ZINC000755216588	BG	On-Demand	Mild	EST1_PIG	66	39
CCCCCCCCNC(=O)[C@@](C)(O)CCC	ZINC000755216588	BG	On-Demand	Mild	CES2C	58	39
CCCCCCCCNC(=O)[C@@](C)(O)CCC	ZINC000755216588	BG	On-Demand	Mild	ASAH1	87	35
CCCCCCCCNC(=O)[C@@](C)(O)CCC	ZINC000755216588	BG	On-Demand	Mild	CQSS	48	30
CCCCCCCCNC(=O)[C@](C)(O)CCC	ZINC000755216589	BG	On-Demand	Mild	CES2	49	39
CCCCCCCCNC(=O)[C@](C)(O)CCC	ZINC000755216589	BG	On-Demand	Mild	CES1	45	33
CCCCCCCCNC(=O)[C@](C)(O)CCC	ZINC000755216589	BG	On-Demand	Mild	EST1_PIG	66	39
CCCCCCCCNC(=O)[C@](C)(O)CCC	ZINC000755216589	BG	On-Demand	Mild	CES2C	58	39
CCCCCCCCNC(=O)[C@](C)(O)CCC	ZINC000755216589	BG	On-Demand	Mild	ASAH1	87	35
CCCCCCCCNC(=O)[C@](C)(O)CCC	ZINC000755216589	BG	On-Demand	Mild	CQSS	48	30
CCCCCCCCNC(=O)[C@@H](CC)N(C)C	ZINC000755216624	BF	On-Demand	Mild	ASAH1	90	35
CCCCCCCCNC(=O)[C@@H](CC)N(C)C	ZINC000755216624	BF	On-Demand	Mild	CQSS	59	39
CCCCCCCCNC(=O)[C@H](CC)N(C)C	ZINC000755216625	BF	On-Demand	Mild	ASAH1	90	35
CCCCCCCCNC(=O)[C@H](CC)N(C)C	ZINC000755216625	BF	On-Demand	Mild	CQSS	59	39
CC(=O)NCCCNC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755224424	DC	On-Demand	Anodyne	CTSK	15	41
CCCCC[C@@H](C)NC(=O)N[C@@H](C)CCCC(F)(F)F	ZINC000755226766	CI	On-Demand	Anodyne	CES2	50	39
CCCCC[C@@H](C)NC(=O)N[C@@H](C)CCCC(F)(F)F	ZINC000755226766	CI	On-Demand	Anodyne	CES1	40	36
CCCCC[C@@H](C)NC(=O)N[C@@H](C)CCCC(F)(F)F	ZINC000755226766	CI	On-Demand	Anodyne	EST1_PIG	76	39
CCCCC[C@@H](C)NC(=O)N[C@@H](C)CCCC(F)(F)F	ZINC000755226766	CI	On-Demand	Anodyne	CES2C	59	39
CCCCC[C@@H](C)NC(=O)N[C@@H](C)CCCC(F)(F)F	ZINC000755226766	CI	On-Demand	Anodyne	CQSS	40	32
CCCCC[C@@H](C)NC(=O)N[C@H](C)CCCC(F)(F)F	ZINC000755226771	CI	On-Demand	Anodyne	CES2	50	39
CCCCC[C@@H](C)NC(=O)N[C@H](C)CCCC(F)(F)F	ZINC000755226771	CI	On-Demand	Anodyne	CES1	40	36
CCCCC[C@@H](C)NC(=O)N[C@H](C)CCCC(F)(F)F	ZINC000755226771	CI	On-Demand	Anodyne	EST1_PIG	76	39
CCCCC[C@@H](C)NC(=O)N[C@H](C)CCCC(F)(F)F	ZINC000755226771	CI	On-Demand	Anodyne	CES2C	59	39
CCCCC[C@@H](C)NC(=O)N[C@H](C)CCCC(F)(F)F	ZINC000755226771	CI	On-Demand	Anodyne	CQSS	40	32
C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)N[C@@H](C)C(=O)N(C)C	ZINC000755227204	DC	On-Demand	Anodyne	CTSK	16	43
C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)N[C@H](C)C(=O)N(C)C	ZINC000755227205	DC	On-Demand	Anodyne	CTSK	16	43
CCCCC[C@@H](C)NC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755227375	DG	On-Demand	Anodyne	PAPA1_CARPA	32	40
CCCCC[C@@H](C)NC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755227375	DG	On-Demand	Anodyne	CTSK	27	52
CCCCC[C@@H](C)NC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755227375	DG	On-Demand	Anodyne	PGA5	25	44
CCOCCCNC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755227787	DD	On-Demand	Anodyne	CTSK	16	44
C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)NCC(=O)N(C)C	ZINC000755227869	DC	On-Demand	Anodyne	CTSK	16	43
C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)NCCNC(=O)OC(C)(C)C	ZINC000755237168	FD	On-Demand	Anodyne	CTSK	17	46
CCCCC[C@@H](C(=O)NNC(=O)NCCCC)C(C)C	ZINC000755239151	CF	On-Demand	Reactive	ASAH1	42	32
CCCCC[C@@H](C(=O)NNC(=O)NCCCC)C(C)C	ZINC000755239151	CF	On-Demand	Reactive	NOD1	43	35
COCC[C@@H](C)NC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755239926	DD	On-Demand	Anodyne	CTSK	16	51
COCC[C@H](C)NC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755239929	DD	On-Demand	Anodyne	CTSK	16	51
C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)NCCOC(C)(C)C	ZINC000755239942	DE	On-Demand	Anodyne	CTSK	15	45
CC[C@H](C)[C@H](C)NC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755243340	DF	On-Demand	Anodyne	CTSK	15	47
CC[C@@H](C)[C@H](C)NC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755243342	DF	On-Demand	Anodyne	CTSK	15	47
C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)NCCO	ZINC000755244234	CC	On-Demand	Anodyne	CTSK	15	44
CC[C@@H](NC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C)C(C)C	ZINC000755244258	DF	On-Demand	Anodyne	CTSK	15	42
C=CC[C@@H](C)NC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755245053	CE	On-Demand	Mild	CTSK	16	44
C=CC[C@H](C)NC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755245054	CE	On-Demand	Mild	CTSK	16	44
C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)N[C@H](C)CCC(C)(C)C	ZINC000755245066	EG	On-Demand	Anodyne	CTSK	18	45
CSCC[C@@H](C)NC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755245294	DE	On-Demand	Anodyne	PAPA1_CARPA	32	49
CSCC[C@@H](C)NC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755245294	DE	On-Demand	Anodyne	CTSK	16	52
CSCC[C@@H](C)NC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755245294	DE	On-Demand	Anodyne	FPR1	17	41
CSCC[C@H](C)NC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755245295	DE	On-Demand	Anodyne	PAPA1_CARPA	32	49
CSCC[C@H](C)NC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755245295	DE	On-Demand	Anodyne	CTSK	16	52
CSCC[C@H](C)NC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755245295	DE	On-Demand	Anodyne	FPR1	17	41
CCC[C@@H](CC)NC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755245685	DF	On-Demand	Anodyne	PAPA1_CARPA	25	41
CCC[C@@H](CC)NC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755245685	DF	On-Demand	Anodyne	CTSK	19	43
CCC[C@H](CC)NC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755245686	DF	On-Demand	Anodyne	PAPA1_CARPA	25	41
CCC[C@H](CC)NC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755245686	DF	On-Demand	Anodyne	CTSK	19	43
CCC(CC)CNC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755247519	DF	On-Demand	Anodyne	CTSK	15	43
CO[C@@H](C)CCNC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755249903	DD	On-Demand	Anodyne	CTSK	15	43
C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)NCCN(C)C(=O)OC(C)(C)C	ZINC000755250626	FE	On-Demand	Anodyne	CTSK	15	42
CCCCC[C@@H](C(=O)NCCOC(C)(C)C)C(C)C	ZINC000755253223	CH	On-Demand	Anodyne	PGA5	23	40
CCCCC[C@@H](C(=O)N(C)CCC)C(C)C	ZINC000755254070	BH	On-Demand	Anodyne	CQSS	40	32
CCCCC[C@@H](C(=O)NNC(=O)NC(C)C)C(C)C	ZINC000755255107	CF	On-Demand	Reactive	CQSS	52	33
CCCC[C@H](NC(=O)[C@@H](C)NC(=O)C(C)(C)C)C(=O)NNC(=O)N(C)C	ZINC000755255607	FC	On-Demand	Reactive	PDF	41	36
CCCC[C@@H](NC(=O)[C@H](C)NC(=O)C(C)(C)C)C(=O)NNC(=O)N(C)C	ZINC000755255608	FC	On-Demand	Reactive	PDF	41	36
CCCC[C@H](NC(=O)[C@H](C)NC(=O)C(C)(C)C)C(=O)NNC(=O)N(C)C	ZINC000755255610	FC	On-Demand	Reactive	PDF	41	36
CCCC[C@@H](NC(=O)[C@@H](C)NC(=O)C(C)(C)C)C(=O)NNC(=O)N(C)C	ZINC000755255612	FC	On-Demand	Reactive	PDF	41	36
C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)NCCCC(C)(C)C	ZINC000755256673	DG	On-Demand	Anodyne	CTSK	15	41
CCCCC[C@@H](C(=O)NNC(=O)N(C)C)C(C)C	ZINC000755257076	CE	On-Demand	Reactive	PDF	45	38
CC[C@@H](C)C[C@H](C)NC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755263119	DG	On-Demand	Anodyne	CTSK	17	44
CC[C@@H](C)C[C@@H](C)NC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755263121	DG	On-Demand	Anodyne	CTSK	17	44
CC[C@H](C)C[C@@H](C)NC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755263122	DG	On-Demand	Anodyne	CTSK	17	44
CCS(=O)(=O)C[C@H](C)NC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755264835	FD	On-Demand	Anodyne	CTSK	15	42
CCS(=O)(=O)C[C@@H](C)NC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755264836	FD	On-Demand	Anodyne	CTSK	15	42
C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)N[C@H](C)CCN(C)C	ZINC000755265377	DD	On-Demand	Anodyne	CTSK	16	41
C[C@@H](CCN(C)C)NC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755265378	DD	On-Demand	Anodyne	CTSK	16	41
C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)NCCC(=O)N(C)C	ZINC000755265386	DC	On-Demand	Anodyne	CTSK	15	43
CNC(=O)CCCNC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755266448	DC	On-Demand	Anodyne	CTSK	15	42
C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)N[C@H](C)CCS(C)(=O)=O	ZINC000755270647	FD	On-Demand	Anodyne	CTSK	15	40
C[C@@H](CCS(C)(=O)=O)NC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755270648	FD	On-Demand	Anodyne	CTSK	15	40
C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)N[C@H](C)CNC(=O)OC(C)(C)C	ZINC000755273617	FE	On-Demand	Anodyne	CTSK	18	50
C=CCCC[C@@H](C)NC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755274343	DF	On-Demand	Mild	CTSK	18	43
C=CCCC[C@H](C)NC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755274344	DF	On-Demand	Mild	CTSK	18	43
C[C@@H](CCCC(F)(F)F)NC(=O)N[C@H](C)CNC(=O)OC(C)(C)C	ZINC000755275126	FG	On-Demand	Anodyne	CTSK	17	53
C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755275181	FE	On-Demand	Anodyne	CTSK	18	50
C#C[C@@H](CCC)NC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755280001	CE	On-Demand	Mild	PAPA1_CARPA	26	42
CCCCC[C@@H](C(=O)NNC(=O)CCC(C)C)C(C)C	ZINC000755282863	CG	On-Demand	Reactive	PGA	15	42
CCCCC[C@@H](C(=O)NNC(=O)CCC(C)C)C(C)C	ZINC000755282863	CG	On-Demand	Reactive	NOD1	55	36
CCCCC[C@@H](C(=O)NNC(=O)CCC(C)C)C(C)C	ZINC000755282863	CG	On-Demand	Reactive	CQSS	52	33
CONC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755291297	BC	On-Demand	Anodyne	CTSK	15	48
CCCCCCCCNC(=O)CN(C)C	ZINC000755293458	BE	On-Demand	Mild	EPHX2	15	47
CCCCCCCCNC(=O)CN(C)C	ZINC000755293458	BE	On-Demand	Mild	ASAH1	94	36
CCCCCCCCNC(=O)CN(C)C	ZINC000755293458	BE	On-Demand	Mild	CQSS	51	31
C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)N[C@H](C)CCCC(F)(F)F	ZINC000755297616	FG	On-Demand	Anodyne	CTSK	17	53
C[C@@H](CCCC(F)(F)F)NC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755297618	FG	On-Demand	Anodyne	CTSK	17	53
CCCCN(CC)C(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755298399	DF	On-Demand	Anodyne	CTSK	20	45
CC[C@@H](C)CN(C)C(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755298466	DF	On-Demand	Anodyne	CTSK	16	42
CCC(CC)CN(CC)C(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755299762	EG	On-Demand	Anodyne	CTSK	15	41
CCCN(CCC)C(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755300911	DF	On-Demand	Anodyne	CTSK	19	44
CCCCC[C@@H](C(=O)NCCC(=O)NC(C)(C)C)C(C)C	ZINC000755311260	CG	On-Demand	Anodyne	NOD1	43	33
CCCCC[C@@H](C(=O)NCC(=O)OC(C)(C)C)C(C)C	ZINC000755325737	CG	On-Demand	Anodyne	PGA5	26	45
CCCCC[C@@H](C(=O)N[C@@H](CC)COC)C(C)C	ZINC000755340045	CG	On-Demand	Anodyne	NOD1	58	33
CCCCC[C@@H](C(=O)N[C@H](CC)COC)C(C)C	ZINC000755340047	CG	On-Demand	Anodyne	NOD1	58	33
CC[C@H](NC(=O)[C@H](C)[C@H](C)NC(=O)OC(C)(C)C)C(C)C	ZINC000755340509	DG	On-Demand	Anodyne	CTSD	23	42
CC[C@H](NC(=O)[C@H](C)[C@H](C)NC(=O)OC(C)(C)C)C(C)C	ZINC000755340509	DG	On-Demand	Anodyne	CTSK	17	48
CC[C@H](NC(=O)[C@H](C)[C@H](C)NC(=O)OC(C)(C)C)C(C)C	ZINC000755340509	DG	On-Demand	Anodyne	PGA	17	42
CC[C@H](NC(=O)[C@H](C)[C@H](C)NC(=O)OC(C)(C)C)C(C)C	ZINC000755340509	DG	On-Demand	Anodyne	ECE1	37	43
CC[C@H](NC(=O)[C@H](C)[C@H](C)NC(=O)OC(C)(C)C)C(C)C	ZINC000755340509	DG	On-Demand	Anodyne	PGA5	25	45
CC[C@H](NC(=O)[C@@H](C)[C@H](C)NC(=O)OC(C)(C)C)C(C)C	ZINC000755340512	DG	On-Demand	Anodyne	CTSD	23	42
CC[C@H](NC(=O)[C@@H](C)[C@H](C)NC(=O)OC(C)(C)C)C(C)C	ZINC000755340512	DG	On-Demand	Anodyne	CTSK	17	48
CC[C@H](NC(=O)[C@@H](C)[C@H](C)NC(=O)OC(C)(C)C)C(C)C	ZINC000755340512	DG	On-Demand	Anodyne	PGA	17	42
CC[C@H](NC(=O)[C@@H](C)[C@H](C)NC(=O)OC(C)(C)C)C(C)C	ZINC000755340512	DG	On-Demand	Anodyne	ECE1	37	43
CC[C@H](NC(=O)[C@@H](C)[C@H](C)NC(=O)OC(C)(C)C)C(C)C	ZINC000755340512	DG	On-Demand	Anodyne	PGA5	25	45
CC[C@H](NC(=O)[C@H](C)[C@@H](C)NC(=O)OC(C)(C)C)C(C)C	ZINC000755340514	DG	On-Demand	Anodyne	CTSD	23	42
CC[C@H](NC(=O)[C@H](C)[C@@H](C)NC(=O)OC(C)(C)C)C(C)C	ZINC000755340514	DG	On-Demand	Anodyne	CTSK	17	48
CC[C@H](NC(=O)[C@H](C)[C@@H](C)NC(=O)OC(C)(C)C)C(C)C	ZINC000755340514	DG	On-Demand	Anodyne	PGA	17	42
CC[C@H](NC(=O)[C@H](C)[C@@H](C)NC(=O)OC(C)(C)C)C(C)C	ZINC000755340514	DG	On-Demand	Anodyne	ECE1	37	43
CC[C@H](NC(=O)[C@H](C)[C@@H](C)NC(=O)OC(C)(C)C)C(C)C	ZINC000755340514	DG	On-Demand	Anodyne	PGA5	25	45
CC[C@H](NC(=O)[C@@H](C)[C@@H](C)NC(=O)OC(C)(C)C)C(C)C	ZINC000755340517	DG	On-Demand	Anodyne	CTSD	23	42
CC[C@H](NC(=O)[C@@H](C)[C@@H](C)NC(=O)OC(C)(C)C)C(C)C	ZINC000755340517	DG	On-Demand	Anodyne	CTSK	17	48
CC[C@H](NC(=O)[C@@H](C)[C@@H](C)NC(=O)OC(C)(C)C)C(C)C	ZINC000755340517	DG	On-Demand	Anodyne	PGA	17	42
CC[C@H](NC(=O)[C@@H](C)[C@@H](C)NC(=O)OC(C)(C)C)C(C)C	ZINC000755340517	DG	On-Demand	Anodyne	ECE1	37	43
CC[C@H](NC(=O)[C@@H](C)[C@@H](C)NC(=O)OC(C)(C)C)C(C)C	ZINC000755340517	DG	On-Demand	Anodyne	PGA5	25	45
CCCCC[C@@H](C(=O)N[C@@H](COC)C(C)C)C(C)C	ZINC000755343180	CH	On-Demand	Anodyne	PGA5	23	41
CCCCC[C@@H](C(=O)N[C@H](COC)C(C)C)C(C)C	ZINC000755343192	CH	On-Demand	Anodyne	PGA5	23	41
C[C@H](NC(=O)OC(C)(C)C)[C@H](C)C(=O)NCCNC(=O)OC(C)(C)C	ZINC000755346137	FE	On-Demand	Anodyne	PAPA1_CARPA	38	42
C[C@H](NC(=O)OC(C)(C)C)[C@H](C)C(=O)NCCNC(=O)OC(C)(C)C	ZINC000755346137	FE	On-Demand	Anodyne	CTSK	19	47
C[C@H](NC(=O)OC(C)(C)C)[C@H](C)C(=O)N[C@H](C)COCC(F)(F)F	ZINC000755347832	FF	On-Demand	Anodyne	CTSK	15	42
CCCCC[C@@H](C(=O)N[C@H](C)C(=O)N(C)C)C(C)C	ZINC000755358159	CE	On-Demand	Anodyne	PDF	71	48
CCCCC[C@@H](C(=O)NCCCC(F)(F)F)C(C)C	ZINC000755361483	CI	On-Demand	Anodyne	ASAH1	47	33
CCC(CC)(CNC(=O)[C@H](C)[C@@H](C)NC(=O)OC(C)(C)C)SC	ZINC000755362234	EH	On-Demand	Anodyne	CTSK	15	40
CCC(CC)(CNC(=O)[C@H](C)[C@H](C)NC(=O)OC(C)(C)C)SC	ZINC000755362236	EH	On-Demand	Anodyne	CTSK	15	40
CCC(CC)(CNC(=O)[C@@H](C)[C@@H](C)NC(=O)OC(C)(C)C)SC	ZINC000755362238	EH	On-Demand	Anodyne	CTSK	15	40
CCC(CC)(CNC(=O)[C@@H](C)[C@H](C)NC(=O)OC(C)(C)C)SC	ZINC000755362240	EH	On-Demand	Anodyne	CTSK	15	40
C[C@H](NC(=O)OC(C)(C)C)[C@H](C)C(=O)NCC(C)(C)S(C)(=O)=O	ZINC000755362783	FD	On-Demand	Anodyne	CTSK	15	40
C[C@H](NC(=O)OC(C)(C)C)[C@H](C)C(=O)NCC(C)(C)NC(=O)OC(C)(C)C	ZINC000755365740	GF	On-Demand	Anodyne	CTSK	15	43
CCS(=O)(=O)C[C@H](C)NC(=O)[C@H](C)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000755366630	FD	On-Demand	Anodyne	CTSK	17	44
CCS(=O)(=O)C[C@H](C)NC(=O)[C@@H](C)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000755366633	FD	On-Demand	Anodyne	CTSK	17	44
CCS(=O)(=O)C[C@H](C)NC(=O)[C@@H](C)[C@H](C)NC(=O)OC(C)(C)C	ZINC000755366634	FD	On-Demand	Anodyne	CTSK	17	44
CCS(=O)(=O)C[C@H](C)NC(=O)[C@H](C)[C@H](C)NC(=O)OC(C)(C)C	ZINC000755366641	FD	On-Demand	Anodyne	CTSK	17	44
CCCCC[C@@H](C(=O)NCCCC(=O)NC)C(C)C	ZINC000755366833	CE	On-Demand	Anodyne	NOD1	61	40
CCCCC[C@@H](C(=O)N(C)C[C@H](C)C(=O)OC)C(C)C	ZINC000755372378	CG	On-Demand	Anodyne	PDF	41	36
CCCCC[C@@H](C(=O)N(C)C[C@H](C)C(=O)OC)C(C)C	ZINC000755372378	CG	On-Demand	Anodyne	NOD1	40	32
CCCCC[C@@H](C(=O)N(C)C[C@@H](C)C(=O)OC)C(C)C	ZINC000755372379	CG	On-Demand	Anodyne	PDF	41	36
CCCCC[C@@H](C(=O)N(C)C[C@@H](C)C(=O)OC)C(C)C	ZINC000755372379	CG	On-Demand	Anodyne	NOD1	40	32
CCCCC[C@@H](C(=O)N[C@H](C)CCN(C)C)C(C)C	ZINC000755372840	CG	On-Demand	Anodyne	PDF	45	40
CCCCC[C@@H](C(=O)N[C@H](C)CCN(C)C)C(C)C	ZINC000755372840	CG	On-Demand	Anodyne	NOD1	40	32
CCCCC[C@@H](C(=O)N[C@@H](C)CCN(C)C)C(C)C	ZINC000755372841	CG	On-Demand	Anodyne	PDF	45	40
CCCCC[C@@H](C(=O)N[C@@H](C)CCN(C)C)C(C)C	ZINC000755372841	CG	On-Demand	Anodyne	NOD1	40	32
C[C@H](CCS(C)(=O)=O)NC(=O)[C@H](C)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000755373611	FD	On-Demand	Anodyne	CTSK	16	40
C[C@H](NC(=O)OC(C)(C)C)[C@H](C)C(=O)N[C@H](C)CCS(C)(=O)=O	ZINC000755373615	FD	On-Demand	Anodyne	CTSK	16	40
C=CC[C@H](C)NC(=O)[C@@H](CCCCC)C(C)C	ZINC000755377957	BH	On-Demand	Mild	NOD1	49	37
C=CC[C@@H](C)NC(=O)[C@@H](CCCCC)C(C)C	ZINC000755377959	BH	On-Demand	Mild	NOD1	49	37
C=CC[C@H](C)NC(=O)[C@H](CCCCC)C(C)C	ZINC000755377961	BH	On-Demand	Mild	NOD1	49	37
C=CC[C@@H](C)NC(=O)[C@H](CCCCC)C(C)C	ZINC000755377962	BH	On-Demand	Mild	NOD1	49	37
C=C[C@H](C)NC(=O)[C@H](C)[C@H](C)NC(=O)OC(C)(C)C	ZINC000755378204	CE	On-Demand	Mild	CTSK	15	51
C=C[C@H](C)NC(=O)[C@@H](C)[C@H](C)NC(=O)OC(C)(C)C	ZINC000755378205	CE	On-Demand	Mild	CTSK	15	51
C=C[C@H](C)NC(=O)[C@@H](C)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000755378206	CE	On-Demand	Mild	CTSK	15	51
C=C[C@H](C)NC(=O)[C@H](C)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000755378207	CE	On-Demand	Mild	CTSK	15	51
C=CCOCCNC(=O)[C@H](C)[C@H](C)NC(=O)OC(C)(C)C	ZINC000755381330	DD	On-Demand	Mild	CTSK	16	42
C=CCOCCNC(=O)[C@@H](C)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000755381331	DD	On-Demand	Mild	CTSK	16	42
C=CCOCCNC(=O)[C@@H](C)[C@H](C)NC(=O)OC(C)(C)C	ZINC000755381332	DD	On-Demand	Mild	CTSK	16	42
C=CCOCCNC(=O)[C@H](C)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000755381333	DD	On-Demand	Mild	CTSK	16	42
CCOC(=O)[C@@H](NC(=O)CCC(=O)N(CC)CC)C(C)(C)C	ZINC000755382192	DD	On-Demand	Anodyne	PDF	41	33
CCCCC[C@@H](C(=O)NCC[C@H](O)C(F)(F)F)C(C)C	ZINC000755382348	CG	On-Demand	Anodyne	CES2	46	35
CCCCC[C@@H](C(=O)NCC[C@H](O)C(F)(F)F)C(C)C	ZINC000755382348	CG	On-Demand	Anodyne	EST1_PIG	63	35
CCCCC[C@@H](C(=O)NCC[C@H](O)C(F)(F)F)C(C)C	ZINC000755382348	CG	On-Demand	Anodyne	CES2C	54	35
CCCCC[C@@H](C(=O)NCC[C@H](O)C(F)(F)F)C(C)C	ZINC000755382348	CG	On-Demand	Anodyne	CQSS	40	33
CCCCC[C@@H](C(=O)NCC[C@@H](O)C(F)(F)F)C(C)C	ZINC000755382356	CG	On-Demand	Anodyne	CES2	46	35
CCCCC[C@@H](C(=O)NCC[C@@H](O)C(F)(F)F)C(C)C	ZINC000755382356	CG	On-Demand	Anodyne	EST1_PIG	63	35
CCCCC[C@@H](C(=O)NCC[C@@H](O)C(F)(F)F)C(C)C	ZINC000755382356	CG	On-Demand	Anodyne	CES2C	54	35
CCCCC[C@@H](C(=O)NCC[C@@H](O)C(F)(F)F)C(C)C	ZINC000755382356	CG	On-Demand	Anodyne	CQSS	40	33
C[C@H](NC(=O)OC(C)(C)C)[C@H](C)C(=O)N[C@H](C)CNC(=O)OC(C)(C)C	ZINC000755383129	FF	On-Demand	Anodyne	CTSK	17	47
C[C@H](NC(=O)OC(C)(C)C)[C@H](C)C(=O)N[C@H](CC(C)(C)C)C(F)(F)F	ZINC000755385066	FI	On-Demand	Anodyne	CTSK	15	45
C[C@H](NC(=O)OC(C)(C)C)[C@H](C)C(=O)N[C@@H](CC(C)(C)C)C(F)(F)F	ZINC000755385069	FI	On-Demand	Anodyne	CTSK	15	45
C[C@H](NC(=O)OC(C)(C)C)[C@H](C)C(=O)N(C)CCN(C)C(=O)OC(C)(C)C	ZINC000755387188	GF	On-Demand	Anodyne	CTSK	15	40
C[C@H](C(=O)N(C)CCN(C)C(=O)OC(C)(C)C)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000755387197	GF	On-Demand	Anodyne	CTSK	15	40
C[C@H](NC(=O)OC(C)(C)C)[C@H](C)C(=O)NCCSCC(F)(F)F	ZINC000755387401	FF	On-Demand	Anodyne	PAPA1_CARPA	34	40
C#CCNC(=O)N[C@@H](CC(C)C)C(=O)NC	ZINC000755390301	BC	On-Demand	Mild	ANPEP	30	46
C#CCNC(=O)N[C@@H](CC(C)C)C(=O)NC	ZINC000755390301	BC	On-Demand	Mild	CTSK	30	44
C#CCNC(=O)N[C@@H](CC(C)C)C(=O)NC	ZINC000755390301	BC	On-Demand	Mild	CTSL	22	41
C#CCNC(=O)N[C@@H](CC(C)C)C(=O)NC	ZINC000755390301	BC	On-Demand	Mild	MMP3	20	41
C#CCNC(=O)N[C@@H](CC(C)C)C(=O)NC	ZINC000755390301	BC	On-Demand	Mild	MMP8	22	48
C#CCNC(=O)N[C@@H](CC(C)C)C(=O)NC	ZINC000755390301	BC	On-Demand	Mild	CTSS	20	44
C#CCNC(=O)N[C@@H](CC(C)C)C(=O)NC	ZINC000755390301	BC	On-Demand	Mild	CAPN1	35	42
C#CCNC(=O)N[C@@H](CC(C)C)C(=O)NC	ZINC000755390301	BC	On-Demand	Mild	MMP9	18	48
CCCCC[C@@H](C(=O)N[C@@H](C)CC(N)=O)C(C)C	ZINC000755405242	CE	On-Demand	Anodyne	NOD1	50	34
CCCCC[C@@H](C(=O)N[C@H](C)CC(N)=O)C(C)C	ZINC000755405245	CE	On-Demand	Anodyne	NOD1	50	34
CCCCCC(C)(C)CNC(=O)[C@H](NC(=O)OC)C(C)C	ZINC000755412494	DG	On-Demand	Anodyne	PGA	16	44
CCCCCC(C)(C)CNC(=O)[C@H](NC(=O)OC)C(C)C	ZINC000755412494	DG	On-Demand	Anodyne	PGA5	31	45
CCCCCC(C)(C)CNC(=O)[C@@H](NC(=O)OC)C(C)C	ZINC000755412496	DG	On-Demand	Anodyne	PGA	16	44
CCCCCC(C)(C)CNC(=O)[C@@H](NC(=O)OC)C(C)C	ZINC000755412496	DG	On-Demand	Anodyne	PGA5	31	45
CCCCCC(C)(C)CNC(=O)CCCC	ZINC000755412612	BH	On-Demand	Anodyne	NOD1	46	34
CCCCCC(C)(C)CNC(=O)CCCC	ZINC000755412612	BH	On-Demand	Anodyne	CQSS	48	30
CCCCCC(C)(C)CNC(=O)CCC(C)(F)F	ZINC000755413051	CI	On-Demand	Anodyne	CES2	49	41
CCCCCC(C)(C)CNC(=O)CCC(C)(F)F	ZINC000755413051	CI	On-Demand	Anodyne	EST1_PIG	68	38
CCCCCC(C)(C)CNC(=O)CCC(C)(F)F	ZINC000755413051	CI	On-Demand	Anodyne	CES2C	58	41
CCCCCC(C)(C)CNC(=O)[C@H](C)CC	ZINC000755413875	BH	On-Demand	Anodyne	CQSS	42	33
CCCCCC(C)(C)CNC(=O)[C@@H](C)CC	ZINC000755413876	BH	On-Demand	Anodyne	CQSS	42	33
CCCCCC(C)(C)CNC(=O)CCC(F)(F)F	ZINC000755414348	CI	On-Demand	Anodyne	CES2	49	41
CCCCCC(C)(C)CNC(=O)CCC(F)(F)F	ZINC000755414348	CI	On-Demand	Anodyne	EST1_PIG	68	38
CCCCCC(C)(C)CNC(=O)CCC(F)(F)F	ZINC000755414348	CI	On-Demand	Anodyne	CES2C	58	41
CCCCCC(C)(C)CNC(=O)[C@H](C)C(F)(F)F	ZINC000755414351	CH	On-Demand	Anodyne	CES2	47	38
CCCCCC(C)(C)CNC(=O)[C@H](C)C(F)(F)F	ZINC000755414351	CH	On-Demand	Anodyne	EST1_PIG	63	38
CCCCCC(C)(C)CNC(=O)[C@H](C)C(F)(F)F	ZINC000755414351	CH	On-Demand	Anodyne	CES2C	56	38
CCCCCC(C)(C)CNC(=O)[C@@H](C)C(F)(F)F	ZINC000755414353	CH	On-Demand	Anodyne	CES2	47	38
CCCCCC(C)(C)CNC(=O)[C@@H](C)C(F)(F)F	ZINC000755414353	CH	On-Demand	Anodyne	EST1_PIG	63	38
CCCCCC(C)(C)CNC(=O)[C@@H](C)C(F)(F)F	ZINC000755414353	CH	On-Demand	Anodyne	CES2C	56	38
C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)CCCS(C)(=O)=O	ZINC000755432735	DC	On-Demand	Anodyne	CTSK	15	42
CCCCS[C@H](C)C(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755433125	DF	On-Demand	Anodyne	CTSK	18	41
CCCCS[C@@H](C)C(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755433128	DF	On-Demand	Anodyne	CTSK	18	41
COCCC[C@@H](C)C(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755435688	DE	On-Demand	Anodyne	PAPA1_CARPA	36	40
COCCC[C@@H](C)C(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755435688	DE	On-Demand	Anodyne	CTSK	18	44
COCCC[C@H](C)C(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755435690	DE	On-Demand	Anodyne	PAPA1_CARPA	36	40
COCCC[C@H](C)C(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755435690	DE	On-Demand	Anodyne	CTSK	18	44
C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)CCCC(C)(C)C	ZINC000755438307	DG	On-Demand	Anodyne	CTSK	19	44
CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)N(C)C[C@H](C)O	ZINC000755438917	DD	On-Demand	Anodyne	PAPA1_CARPA	34	56
CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)N(C)C[C@H](C)O	ZINC000755438917	DD	On-Demand	Anodyne	CTSK	16	56
CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)N(C)C[C@H](C)O	ZINC000755438917	DD	On-Demand	Anodyne	FPR1	34	47
C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)[C@@H](C)[C@H](C)NC(=O)OC(C)(C)C	ZINC000755439512	FF	On-Demand	Anodyne	CTSK	17	47
C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)[C@@H](C)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000755439515	FF	On-Demand	Anodyne	CTSK	17	47
C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)[C@H](C)[C@H](C)NC(=O)OC(C)(C)C	ZINC000755439519	FF	On-Demand	Anodyne	CTSK	17	47
C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)[C@H](C)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000755439523	FF	On-Demand	Anodyne	CTSK	17	47
COCC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755439539	BC	On-Demand	Anodyne	CTSK	15	48
CCCCCC[C@](C)(CCC)C(=O)N(C)C[C@H](C)O	ZINC000755442340	CH	On-Demand	Anodyne	CQSS	44	36
CCCCCC[C@](C)(CCC)C(=O)N(C)C[C@@H](C)O	ZINC000755442341	CH	On-Demand	Anodyne	CQSS	44	36
CCC(CC)[C@@H](C)C(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755442758	DG	On-Demand	Anodyne	CTSK	16	44
CCC(CC)[C@H](C)C(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755442760	DG	On-Demand	Anodyne	CTSK	16	44
C#CCOCCC(=O)N[C@@H](C)CCC	ZINC000755443831	AD	On-Demand	Mild	NOD1	50	33
C#CCOCCC(=O)N[C@H](C)CCC	ZINC000755443832	AD	On-Demand	Mild	NOD1	50	33
COC(=O)N[C@@H](C)C(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755443931	DC	On-Demand	Anodyne	PAPA1_CARPA	37	40
COC(=O)N[C@@H](C)C(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755443931	DC	On-Demand	Anodyne	CTSK	19	48
COC(=O)N[C@@H](C)C(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755443931	DC	On-Demand	Anodyne	FPR1	32	43
C=C(C)[C@@H](CC(=O)NCCCCCC)OCC	ZINC000755444278	BG	On-Demand	Mild	ASAH1	67	33
C=C(C)[C@H](CC(=O)NCCCCCC)OCC	ZINC000755444281	BG	On-Demand	Mild	ASAH1	67	33
C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)CCCSC(C)(C)C	ZINC000755445091	EG	On-Demand	Anodyne	CTSK	16	42
C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)CCCCNC(N)=O	ZINC000755445095	DC	On-Demand	Anodyne	CTSK	16	43
C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)CCCCNC(N)=O	ZINC000755445095	DC	On-Demand	Anodyne	NOD1	45	34
CCC[C@@H](NC(N)=O)C(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755446186	DC	On-Demand	Anodyne	PAPA1_CARPA	39	51
CCC[C@@H](NC(N)=O)C(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755446186	DC	On-Demand	Anodyne	CTSK	23	42
CCC[C@@H](NC(N)=O)C(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755446186	DC	On-Demand	Anodyne	CAPN1	25	46
CCC[C@@H](NC(N)=O)C(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755446186	DC	On-Demand	Anodyne	CAPN2	56	40
CSCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N(C)C[C@@H](C)O	ZINC000755448553	DD	On-Demand	Anodyne	PAPA1_CARPA	34	56
CSCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N(C)C[C@@H](C)O	ZINC000755448553	DD	On-Demand	Anodyne	CTSK	16	56
CSCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N(C)C[C@@H](C)O	ZINC000755448553	DD	On-Demand	Anodyne	FPR1	34	47
CSCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N(C)C[C@H](C)O	ZINC000755448554	DD	On-Demand	Anodyne	PAPA1_CARPA	34	56
CSCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N(C)C[C@H](C)O	ZINC000755448554	DD	On-Demand	Anodyne	CTSK	16	56
CSCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N(C)C[C@H](C)O	ZINC000755448554	DD	On-Demand	Anodyne	FPR1	34	47
CCCCC[C@@H](C(=O)NOCCOC)C(C)C	ZINC000755448947	BF	On-Demand	Anodyne	NOD1	48	31
C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)CC(C)(C)C	ZINC000755452617	CE	On-Demand	Anodyne	CTSK	15	45
C=C(C)[C@H](CC(=O)N[C@@H](C)CCCCC)OCC	ZINC000755452774	CG	On-Demand	Mild	NOD1	55	34
C=C(C)[C@H](CC(=O)N[C@H](C)CCCCC)OCC	ZINC000755452775	CG	On-Demand	Mild	NOD1	55	34
C=C(C)[C@@H](CC(=O)N[C@@H](C)CCCCC)OCC	ZINC000755452777	CG	On-Demand	Mild	NOD1	55	34
C=C(C)[C@@H](CC(=O)N[C@H](C)CCCCC)OCC	ZINC000755452778	CG	On-Demand	Mild	NOD1	55	34
COC(=O)C[C@@H](C)C(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755455079	DD	On-Demand	Anodyne	PAPA1_CARPA	38	40
COC(=O)C[C@@H](C)C(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755455079	DD	On-Demand	Anodyne	CTSK	15	46
CC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755456804	BD	On-Demand	Anodyne	CTSK	17	49
CC[C@@H](C)CC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755458131	CE	On-Demand	Anodyne	CTSD	17	40
CC[C@@H](C)CC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755458131	CE	On-Demand	Anodyne	CTSK	18	45
CC[C@@H](C)CC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	ZINC000755458131	CE	On-Demand	Anodyne	ECE1	27	40
CC(=O)N[C@@H](C(=O)N[C@@H](C)CNC(=O)OC(C)(C)C)C(C)C	ZINC000755458522	DD	On-Demand	Anodyne	CTSD	26	42
CC(=O)N[C@@H](C(=O)N[C@@H](C)CNC(=O)OC(C)(C)C)C(C)C	ZINC000755458522	DD	On-Demand	Anodyne	PAPA1_CARPA	48	43
CC(=O)N[C@@H](C(=O)N[C@@H](C)CNC(=O)OC(C)(C)C)C(C)C	ZINC000755458522	DD	On-Demand	Anodyne	PGA	52	42
CC(=O)N[C@@H](C(=O)N[C@@H](C)CNC(=O)OC(C)(C)C)C(C)C	ZINC000755458522	DD	On-Demand	Anodyne	CASP1	15	43
CC(=O)N[C@@H](C(=O)N[C@@H](C)CNC(=O)OC(C)(C)C)C(C)C	ZINC000755458522	DD	On-Demand	Anodyne	PGA5	34	43
CC(=O)N[C@@H](C(=O)N[C@@H](C)CNC(=O)OC(C)(C)C)C(C)C	ZINC000755458522	DD	On-Demand	Anodyne	POLG_HCV1	21	44
CCCCCC(C)(C)CNC(=O)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000755462049	DH	On-Demand	Anodyne	PAPA1_CARPA	33	41
CCCCCC(C)(C)CNC(=O)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000755462049	DH	On-Demand	Anodyne	CTSK	21	47
CCCCCC(C)(C)CNC(=O)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000755462049	DH	On-Demand	Anodyne	PGA5	25	43